data_1idh_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 1idh _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 ' 1' ' ' ILE . . . . . . . . . . . . . 19.2 mm . . . . . 0 N--CA 1.485 1.278 0 CA-C-O 120.846 0.355 . . . . 0.0 111.132 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 27.7 m -136.19 169.78 19.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.99 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 3.2 t -160.31 100.65 1.36 Allowed 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 -179.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' HIS . . . . . 0.404 ' CE1' ' HA ' ' A' ' 64' ' ' LYS . 3.7 m170 -36.01 120.36 0.62 Allowed 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.48 179.392 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -84.44 99.86 10.95 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.978 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.445 ' CG2' ' N ' ' A' ' 7' ' ' ALA . 0.4 OUTLIER 81.17 -53.97 0.3 Allowed 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.213 179.784 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.445 ' N ' ' CG2' ' A' ' 6' ' ' THR . . . 58.98 -96.14 0.06 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.681 -0.236 . . . . 0.0 110.884 -179.688 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 5.3 p . . . . . 0 CA--C 1.529 0.156 0 CA-C-O 120.673 0.273 . . . . 0.0 111.396 179.666 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.451 ' HB2' ' HD3' ' A' ' 18' ' ' PRO . 46.2 Cg_exo . . . . . 0 CA--C 1.528 0.213 0 N-CA-C 112.691 0.227 . . . . 0.0 112.691 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.451 ' HD3' ' HB2' ' A' ' 17' ' ' PRO . 71.8 Cg_endo -78.45 164.77 25.99 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.281 1.987 . . . . 0.0 112.36 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 48.37 87.12 0.01 OUTLIER Glycine 0 C--N 1.33 0.237 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.437 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -87.37 82.14 7.65 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.828 0.347 . . . . 0.0 111.263 -179.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . 0.408 ' O ' ' HB2' ' A' ' 61' ' ' SER . 0.8 OUTLIER -168.38 -74.49 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.968 179.73 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.448 ' CD2' ' HB2' ' A' ' 59' ' ' CYS . 1.0 OUTLIER -125.45 154.42 42.03 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.018 -179.626 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.546 ' HA ' ' HA ' ' A' ' 44' ' ' CYS . 2.4 p -109.34 29.15 7.82 Favored 'General case' 0 CA--C 1.534 0.354 0 N-CA-C 112.228 0.455 . . . . 0.0 112.228 -179.172 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.646 ' O ' ' HB2' ' A' ' 60' ' ' CYS . 1.9 m-85 34.82 -159.25 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 122.774 0.43 . . . . 0.0 111.654 179.385 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.572 ' CB ' ' O ' ' A' ' 24' ' ' TYR . 1.2 mtp180 97.23 117.17 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 122.591 0.356 . . . . 0.0 111.513 179.749 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -147.98 -93.82 0.08 Allowed 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.236 178.725 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 1.9 mtm 172.15 -164.12 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.255 0 C-N-CA 121.108 -0.237 . . . . 0.0 110.773 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 18.1 t-105 -133.18 -84.53 0.46 Allowed 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 116.592 -0.276 . . . . 0.0 111.062 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER 54.53 175.14 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 120.813 0.339 . . . . 0.0 110.726 -179.63 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -86.21 -76.23 0.35 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.983 0.421 . . . . 0.0 110.277 179.456 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -118.1 -130.67 0.3 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.854 179.251 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . 0.468 ' O ' ' N ' ' A' ' 34' ' ' SER . 26.7 p90 -68.47 -35.89 78.19 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 179.121 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER 34.62 -86.19 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 115.345 -0.843 . . . . 0.0 112.771 179.485 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.468 ' N ' ' O ' ' A' ' 32' ' ' PHE . 0.3 OUTLIER 78.32 28.54 0.48 Allowed 'General case' 0 N--CA 1.462 0.173 0 CA-C-O 120.967 0.413 . . . . 0.0 110.338 -179.175 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 1.6 p -152.95 -66.41 0.16 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.621 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.4 ' HG3' ' N ' ' A' ' 37' ' ' GLY . 0.2 OUTLIER -86.45 -155.36 0.25 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.718 179.821 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.4 ' N ' ' HG3' ' A' ' 36' ' ' ARG . . . 88.91 20.19 47.88 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.711 -0.756 . . . . 0.0 112.49 -179.574 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.433 ' HA ' ' HG3' ' A' ' 70' ' ' LYS . 0.1 OUTLIER . . . . . 0 N--CA 1.464 0.233 0 CA-C-O 121.227 0.537 . . . . 0.0 111.629 -179.726 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . 0.45 ' N ' ' HG2' ' A' ' 25' ' ' ARG . . . . . . . . 0 N--CA 1.451 -0.318 0 CA-C-O 120.817 0.12 . . . . 0.0 113.336 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.546 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 0.1 OUTLIER 62.79 144.66 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.17 0.509 . . . . 0.0 112.286 178.819 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.476 ' HB2' ' CD2' ' A' ' 24' ' ' TYR . . . -147.06 -68.78 0.25 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.747 179.33 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 166.14 -37.01 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.666 179.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 10.4 t -178.78 173.21 1.27 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.637 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.518 ' N ' ' HD3' ' A' ' 49' ' ' PRO . 22.3 p -142.76 52.81 2.42 Favored Pre-proline 0 C--N 1.331 -0.196 0 N-CA-C 111.995 0.369 . . . . 0.0 111.995 -179.778 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.518 ' HD3' ' N ' ' A' ' 48' ' ' CYS . 32.3 Cg_exo -57.52 -21.64 47.11 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 121.849 1.699 . . . . 0.0 110.82 178.526 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 3.5 t -61.46 -166.91 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.248 -0.887 . . . . 0.0 111.108 179.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 2.0 ptmm? 177.86 39.91 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.706 179.779 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.429 ' HD2' ' O ' ' A' ' 52' ' ' LYS . 0.0 OUTLIER -76.92 154.99 83.05 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.141 -179.924 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -71.19 -89.58 0.0 OUTLIER 'Trans proline' 0 CA--C 1.531 0.365 0 C-N-CA 122.457 2.105 . . . . 0.0 112.184 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.469 0.509 0 CA-C-O 120.597 0.237 . . . . 0.0 110.603 179.779 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.42 ' O ' ' HB3' ' A' ' 48' ' ' CYS . 0.2 OUTLIER . . . . . 0 N--CA 1.456 -0.159 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . 0.457 ' HB3' ' HB3' ' A' ' 48' ' ' CYS . 1.3 p 178.73 146.88 0.17 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.552 179.425 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . 0.646 ' HB2' ' O ' ' A' ' 24' ' ' TYR . 11.9 m -133.96 84.68 2.14 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.462 -179.256 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.419 ' CB ' ' CD2' ' A' ' 22' ' ' LEU . 2.1 t -93.58 74.75 4.4 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.91 0.386 . . . . 0.0 110.832 179.879 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -157.95 -164.28 1.49 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.7 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 10.8 p-10 -124.61 28.25 6.63 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.197 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.404 ' HA ' ' CE1' ' A' ' 4' ' ' HIS . 0.6 OUTLIER 179.54 43.81 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.05 0.452 . . . . 0.0 110.776 179.776 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . 0.402 ' O ' ' HD3' ' A' ' 67' ' ' PRO . 13.5 t -77.79 -27.23 50.15 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.084 -179.91 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -58.52 105.32 0.52 Allowed Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.456 -179.65 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . 0.402 ' HD3' ' O ' ' A' ' 65' ' ' CYS . 7.1 Cg_exo -73.51 -156.16 0.05 OUTLIER 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.757 2.305 . . . . 0.0 111.908 179.576 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.418 ' CB ' ' HD2' ' A' ' 69' ' ' PRO . 0.7 OUTLIER -106.77 166.59 10.85 Favored Pre-proline 0 C--N 1.331 -0.211 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.818 179.831 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . 0.418 ' HD2' ' CB ' ' A' ' 68' ' ' HIS . 9.9 Cg_endo -53.47 177.33 0.07 OUTLIER 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.619 2.212 . . . . 0.0 112.528 -179.845 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.433 ' HG3' ' HA ' ' A' ' 38' ' ' LYS . 3.0 mmpt? -85.11 -56.48 3.53 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.351 -179.623 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 31.7 mt-30 . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.446 -179.682 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 192' ' ' CYS . . . . . 0.702 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.0 OUTLIER . . . . . 0 CA--C 1.499 -0.988 0 CA-C-O 122.06 0.933 . . . . 0.0 112.101 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 193' ' ' CYS . . . . . 0.702 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.1 OUTLIER 41.09 68.6 2.37 Favored Pre-proline 0 C--N 1.314 -0.948 0 CA-C-N 113.149 -1.842 . . . . 0.0 112.209 173.817 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 194' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -73.1 -70.72 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.845 2.363 . . . . 0.0 112.422 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 166.56 -20.69 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.465 -179.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 196' ' ' THR . . . . . 0.774 ' C ' ' H ' ' B' ' 198' ' ' TYR . 0.6 OUTLIER -79.36 -20.84 0.33 Allowed Pre-proline 0 C--N 1.331 -0.198 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -179.744 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 197' ' ' PRO . . . . . 0.685 ' CD ' ' N ' ' B' ' 196' ' ' THR . 17.8 Cg_exo -64.26 25.13 0.07 OUTLIER 'Trans proline' 0 C--N 1.353 0.815 0 C-N-CA 121.218 1.279 . . . . 0.0 109.575 176.733 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 198' ' ' TYR . . . . . 0.774 ' H ' ' C ' ' B' ' 196' ' ' THR . 5.6 t80 . . . . . 0 C--O 1.248 1.022 0 CA-C-N 114.372 -1.285 . . . . 0.0 111.346 -178.74 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 1' ' ' ILE . . . . . 0.46 HG22 HD11 ' A' ' 1' ' ' ILE . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.375 0 CA-C-O 120.989 0.423 . . . . 0.0 111.131 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 9.9 m -132.38 -179.56 3.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.351 179.496 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 7.9 t -135.16 118.09 16.29 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.594 -0.442 . . . . 0.0 112.114 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' HIS . . . . . 0.455 ' CD2' ' CB ' ' A' ' 64' ' ' LYS . 1.3 m-70 -35.07 143.55 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.343 179.356 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.34 -164.23 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.47 -179.306 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 13.9 t -90.6 42.64 1.11 Allowed 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 112.295 0.479 . . . . 0.0 112.295 -178.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.439 ' HB3' ' HG2' ' B' ' 194' ' ' PRO . . . -150.52 -178.6 6.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.53 0.205 . . . . 0.0 111.003 179.312 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.501 ' HB ' ' HA ' ' B' ' 192' ' ' CYS . 0.5 OUTLIER . . . . . 0 CA--C 1.539 0.529 0 CA-C-N 116.687 -0.233 . . . . 0.0 110.966 -179.521 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.614 ' N ' ' HD2' ' A' ' 18' ' ' PRO . 77.9 Cg_exo . . . . . 0 CA--C 1.532 0.391 0 N-CA-C 113.461 0.523 . . . . 0.0 113.461 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.614 ' HD2' ' N ' ' A' ' 17' ' ' PRO . 5.7 Cg_endo -48.97 -177.49 0.01 OUTLIER 'Trans proline' 0 C--N 1.351 0.685 0 C-N-CA 122.527 2.152 . . . . 0.0 112.766 -179.209 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . 0.406 ' O ' ' CB ' ' A' ' 20' ' ' GLU . . . -42.25 91.03 0.01 OUTLIER Glycine 0 C--N 1.334 0.452 0 CA-C-N 116.0 -0.546 . . . . 0.0 113.164 -179.606 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.439 ' N ' ' O ' ' A' ' 18' ' ' PRO . 1.6 mt-10 162.95 -173.46 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 122.595 0.358 . . . . 0.0 110.2 -179.87 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 8.1 m-20 -178.94 -79.47 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.806 0.336 . . . . 0.0 111.194 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.512 ' O ' ' HA ' ' A' ' 44' ' ' CYS . 3.5 tm? -59.05 91.72 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.316 -179.725 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.533 ' HA ' ' HA ' ' A' ' 44' ' ' CYS . 4.6 t -66.02 63.06 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 120.738 0.304 . . . . 0.0 111.272 179.828 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.472 ' CE1' ' HA3' ' A' ' 43' ' ' GLY . 6.7 p90 -47.88 145.27 3.0 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.019 0.438 . . . . 0.0 111.933 -179.62 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.26 137.76 37.8 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.485 179.744 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -78.25 150.48 33.4 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.955 -179.886 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' MET . . . . . 0.432 ' O ' ' N ' ' A' ' 29' ' ' CYS . 14.7 ptm -143.54 79.29 1.63 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.976 179.885 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' TRP . . . . . 0.404 ' O ' ' HA2' ' A' ' 37' ' ' GLY . 69.2 t-105 -58.63 79.77 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.341 -179.831 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . 0.432 ' N ' ' O ' ' A' ' 27' ' ' MET . 0.5 OUTLIER -170.02 119.02 0.6 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.074 179.762 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.79 -162.01 0.59 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.77 179.949 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -56.37 -38.13 71.01 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.328 -179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 27.3 m-85 -102.96 -79.17 0.53 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.921 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.477 ' O ' ' N ' ' A' ' 35' ' ' SER . 19.5 p 38.22 30.77 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 112.208 0.447 . . . . 0.0 112.208 179.773 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.3 m 48.46 -86.9 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 116.594 -0.276 . . . . 0.0 111.392 -179.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.477 ' N ' ' O ' ' A' ' 33' ' ' CYS . 97.6 p -176.49 71.23 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.787 0.327 . . . . 0.0 110.841 179.803 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 20.8 mtt180 -115.05 -87.93 0.58 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.1 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.404 ' HA2' ' O ' ' A' ' 28' ' ' TRP . . . 51.6 23.32 9.63 Favored Glycine 0 C--N 1.334 0.431 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.996 179.883 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.547 ' CB ' ' HG3' ' A' ' 70' ' ' LYS . 0.0 OUTLIER . . . . . 0 CA--C 1.532 0.28 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 -179.422 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . 0.472 ' HA3' ' CE1' ' A' ' 24' ' ' TYR . . . . . . . . 0 N--CA 1.45 -0.385 0 N-CA-C 113.522 0.169 . . . . 0.0 113.522 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.533 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 0.0 OUTLIER 70.41 99.53 0.06 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.239 0.543 . . . . 0.0 111.277 -179.263 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -128.4 -139.49 0.24 Allowed 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 115.342 -0.845 . . . . 0.0 110.09 179.747 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -167.98 36.53 0.03 OUTLIER 'General case' 0 C--N 1.334 -0.1 0 O-C-N 122.253 -0.28 . . . . 0.0 111.658 179.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 6.8 t -176.81 40.89 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 120.99 -0.284 . . . . 0.0 111.718 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 63.5 m 39.24 73.23 0.83 Allowed Pre-proline 0 N--CA 1.466 0.355 0 CA-C-N 116.731 -0.213 . . . . 0.0 111.538 179.712 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -53.14 -19.08 11.32 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.128 1.886 . . . . 0.0 110.847 178.601 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.445 ' HB2' ' HA ' ' A' ' 58' ' ' THR . 39.5 t -38.24 -74.19 0.04 OUTLIER 'General case' 0 N--CA 1.457 -0.088 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.983 179.347 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 23.3 mmtt 67.89 -161.87 0.21 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.581 -179.705 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.599 ' CB ' ' CD ' ' A' ' 53' ' ' PRO . 9.5 mmmt -96.6 -163.72 0.05 OUTLIER Pre-proline 0 CA--C 1.539 0.533 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.617 -179.522 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . 0.599 ' CD ' ' CB ' ' A' ' 52' ' ' LYS . 35.5 Cg_exo -39.98 -28.3 0.25 Allowed 'Trans proline' 0 C--N 1.356 0.945 0 C-N-CA 122.644 2.229 . . . . 0.0 114.484 -178.587 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . 0.455 ' CZ ' ' HB2' ' A' ' 52' ' ' LYS . 0.1 OUTLIER . . . . . 0 N--CA 1.474 0.767 0 C-N-CA 120.556 -0.458 . . . . 0.0 111.422 -179.723 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.445 ' HA ' ' HB2' ' A' ' 50' ' ' SER . 0.0 OUTLIER . . . . . 0 CA--C 1.529 0.145 0 N-CA-C 110.412 -0.218 . . . . 0.0 110.412 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . 0.401 ' SG ' HD23 ' A' ' 22' ' ' LEU . 1.6 t -50.63 105.79 0.11 Allowed 'General case' 0 C--O 1.232 0.183 0 CA-C-O 121.025 0.44 . . . . 0.0 110.239 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . 0.446 ' N ' HD23 ' A' ' 22' ' ' LEU . 0.5 OUTLIER -78.31 -97.04 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 115.902 -0.59 . . . . 0.0 112.315 -178.522 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.481 ' N ' HD22 ' A' ' 22' ' ' LEU . 13.1 t 39.1 88.18 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 111.608 0.225 . . . . 0.0 111.608 -179.516 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER 175.75 -59.49 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 111.791 0.293 . . . . 0.0 111.791 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -130.76 -158.8 0.92 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.784 0.326 . . . . 0.0 111.381 -179.251 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.455 ' CB ' ' CD2' ' A' ' 4' ' ' HIS . 0.7 OUTLIER -77.49 -2.43 35.44 Favored 'General case' 0 N--CA 1.461 0.124 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.975 -179.467 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 56.1 m 36.02 42.26 0.16 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.952 -0.567 . . . . 0.0 112.354 179.39 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -133.4 53.03 9.5 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 120.695 0.283 . . . . 0.0 111.491 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -79.81 -167.55 0.52 Allowed 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.534 2.156 . . . . 0.0 112.184 179.532 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 41.8 m80 -68.97 112.1 10.49 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.671 179.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_exo -60.9 -67.14 0.05 OUTLIER 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.476 2.117 . . . . 0.0 112.517 -179.536 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.547 ' HG3' ' CB ' ' A' ' 38' ' ' LYS . 1.0 OUTLIER -73.76 145.97 44.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.011 0.434 . . . . 0.0 111.087 -179.71 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.328 -0.36 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.212 -179.715 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 192' ' ' CYS . . . . . 0.685 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.0 OUTLIER . . . . . 0 CA--C 1.498 -1.034 0 CA-C-O 122.132 0.968 . . . . 0.0 111.399 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 193' ' ' CYS . . . . . 0.685 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.1 OUTLIER 38.61 48.09 1.5 Allowed Pre-proline 0 C--N 1.314 -0.942 0 CA-C-N 112.995 -1.911 . . . . 0.0 112.843 174.12 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 194' ' ' PRO . . . . . 0.679 ' HD3' ' N ' ' B' ' 193' ' ' CYS . 57.3 Cg_endo -100.67 -69.6 0.0 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.966 0 C-N-CA 123.602 2.868 . . . . 0.0 112.838 -179.452 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -70.46 -84.75 0.03 OUTLIER 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.153 -0.476 . . . . 0.0 112.012 -179.131 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 196' ' ' THR . . . . . 0.636 ' C ' ' H ' ' B' ' 198' ' ' TYR . 10.2 t -160.17 52.04 0.43 Allowed Pre-proline 0 C--N 1.332 -0.16 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 -179.089 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 197' ' ' PRO . . . . . 0.588 ' HD3' ' N ' ' B' ' 196' ' ' THR . 2.6 Cg_exo -73.08 15.89 0.46 Allowed 'Trans proline' 0 N--CA 1.459 -0.514 0 C-N-CA 121.879 1.72 . . . . 0.0 108.73 175.848 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 198' ' ' TYR . . . . . 0.636 ' H ' ' C ' ' B' ' 196' ' ' THR . 51.4 t80 . . . . . 0 C--O 1.25 1.079 0 CA-C-N 113.939 -1.482 . . . . 0.0 111.176 -178.6 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 24.5 mm . . . . . 0 N--CA 1.486 1.355 0 CA-C-O 120.789 0.328 . . . . 0.0 111.068 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -155.0 -176.18 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.901 179.872 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 21.6 m -103.45 -174.63 2.59 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.147 0.499 . . . . 0.0 111.561 -179.537 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' HIS . . . . . 0.5 ' CD2' ' O ' ' A' ' 4' ' ' HIS . 4.3 t60 -139.53 97.59 3.31 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.925 179.307 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.1 m 28.63 36.78 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 114.673 -1.149 . . . . 0.0 112.71 -179.736 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.473 ' N ' ' O ' ' A' ' 4' ' ' HIS . 21.0 m 48.94 21.67 0.49 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.604 0.24 . . . . 0.0 111.624 -179.813 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 44.61 30.07 0.48 Allowed 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 120.756 0.313 . . . . 0.0 111.51 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 30.2 m . . . . . 0 C--N 1.33 -0.252 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.864 -179.824 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo . . . . . 0 C--O 1.233 0.225 0 CA-C-O 120.682 0.201 . . . . 0.0 112.297 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -63.58 161.21 32.66 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.509 2.139 . . . . 0.0 112.214 179.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 46.78 70.85 0.61 Allowed Glycine 0 CA--C 1.518 0.23 0 C-N-CA 120.957 -0.639 . . . . 0.0 112.66 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -151.2 -177.28 5.95 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.894 0.378 . . . . 0.0 111.046 -179.785 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . 0.431 ' HB3' ' CB ' ' A' ' 45' ' ' ALA . 0.8 OUTLIER -107.25 69.59 0.76 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.959 -179.954 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.439 ' CG ' ' HA ' ' A' ' 61' ' ' SER . 0.2 OUTLIER 49.88 -96.41 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.795 -0.639 . . . . 0.0 112.256 179.585 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.526 ' C ' ' H ' ' A' ' 44' ' ' CYS . 0.9 OUTLIER -158.66 30.76 0.23 Allowed 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 113.268 0.84 . . . . 0.0 113.268 -178.485 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.539 ' CE1' ' HA ' ' A' ' 58' ' ' THR . 0.1 OUTLIER 55.07 161.21 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 118.2 0.454 . . . . 0.0 110.788 178.624 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -150.93 63.32 0.92 Allowed 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.503 0.557 . . . . 0.0 112.503 179.841 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -51.02 132.93 27.69 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.087 0.47 . . . . 0.0 111.62 179.853 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 2.7 ptp -152.96 110.34 3.53 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.342 179.578 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' TRP . . . . . 0.414 ' O ' ' N ' ' A' ' 30' ' ' ASP . 26.4 t90 -79.89 -78.77 0.16 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.583 -179.314 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . 0.451 ' HB3' ' H ' ' A' ' 30' ' ' ASP . 2.4 t 52.62 -89.98 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.303 -178.995 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.451 ' H ' ' HB3' ' A' ' 29' ' ' CYS . 82.9 m-20 44.93 -177.31 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 120.953 0.406 . . . . 0.0 111.894 179.223 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . 39.45 -145.72 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.405 179.757 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -92.49 44.72 1.17 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.872 0.367 . . . . 0.0 110.889 179.707 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 6.2 p -55.66 125.49 21.37 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.796 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 2.8 m -48.22 -52.94 18.78 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.513 -179.679 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.412 ' CB ' ' HB2' ' A' ' 70' ' ' LYS . 1.3 m -137.79 166.96 22.72 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.041 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 2.5 mtm-85 -89.32 108.66 19.75 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.899 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.4 ' N ' ' HB3' ' A' ' 70' ' ' LYS . . . 163.46 -163.54 35.69 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.404 -0.903 . . . . 0.0 112.579 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.294 0 CA-C-O 120.686 0.279 . . . . 0.0 110.702 -179.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.555 0 N-CA-C 114.358 0.503 . . . . 0.0 114.358 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.526 ' H ' ' C ' ' A' ' 23' ' ' CYS . 87.6 m 58.69 114.93 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 117.128 0.464 . . . . 0.0 111.611 179.122 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.45 ' HA ' ' CE2' ' A' ' 24' ' ' TYR . . . -85.84 169.65 13.14 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.964 179.639 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -110.34 -39.28 5.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.821 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.449 ' OG1' ' HD3' ' A' ' 49' ' ' PRO . 11.7 t -138.53 164.3 29.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.112 179.724 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.594 ' N ' ' HD3' ' A' ' 49' ' ' PRO . 0.9 OUTLIER -132.59 44.45 1.33 Allowed Pre-proline 0 CA--C 1.532 0.254 0 N-CA-C 112.762 0.652 . . . . 0.0 112.762 -179.077 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.594 ' HD3' ' N ' ' A' ' 48' ' ' CYS . 55.4 Cg_endo -91.43 18.38 1.22 Allowed 'Trans proline' 0 N--CA 1.455 -0.789 0 C-N-CA 122.517 2.144 . . . . 0.0 110.518 177.817 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.462 ' O ' ' CD ' ' A' ' 52' ' ' LYS . 9.8 t -105.71 -112.99 0.26 Allowed 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 115.283 -0.871 . . . . 0.0 111.427 -178.412 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.436 ' CG ' ' O ' ' A' ' 50' ' ' SER . 0.6 OUTLIER 51.99 24.94 2.85 Favored 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 122.437 0.295 . . . . 0.0 111.681 -179.847 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.711 ' HB2' ' HD3' ' A' ' 53' ' ' PRO . 0.3 OUTLIER -143.3 -54.19 0.02 OUTLIER Pre-proline 0 CA--C 1.533 0.301 0 N-CA-C 111.935 0.346 . . . . 0.0 111.935 179.527 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . 0.711 ' HD3' ' HB2' ' A' ' 52' ' ' LYS . 15.3 Cg_exo -69.3 153.62 70.76 Favored 'Trans proline' 0 C--N 1.35 0.639 0 C-N-CA 122.253 1.969 . . . . 0.0 112.565 -179.633 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.468 0.439 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.505 179.777 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.539 ' HA ' ' CE1' ' A' ' 24' ' ' TYR . 0.2 OUTLIER . . . . . 0 CA--C 1.52 -0.186 0 CA-C-O 120.422 0.153 . . . . 0.0 110.902 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . 0.479 ' SG ' ' O ' ' A' ' 58' ' ' THR . 15.4 m -167.94 158.51 10.65 Favored 'General case' 0 CA--C 1.528 0.117 0 CA-C-O 121.741 0.781 . . . . 0.0 112.814 179.716 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . 0.425 ' O ' ' CB ' ' A' ' 22' ' ' LEU . 0.2 OUTLIER 170.47 129.35 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 114.241 -1.345 . . . . 0.0 109.159 178.646 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.439 ' HA ' ' CG ' ' A' ' 22' ' ' LEU . 16.1 p -176.78 170.55 2.34 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.916 0.388 . . . . 0.0 111.336 -179.238 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER 48.73 38.2 11.2 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.45 179.803 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 179.01 -174.64 0.19 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.769 179.813 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.425 ' HB2' ' ND2' ' A' ' 66' ' ' ASN . 12.8 mmtm -101.91 17.99 21.73 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.221 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . 0.402 ' HB2' ' O ' ' A' ' 64' ' ' LYS . 56.3 m 68.25 -49.62 0.55 Allowed 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 112.361 0.504 . . . . 0.0 112.361 179.499 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.425 ' ND2' ' HB2' ' A' ' 64' ' ' LYS . 10.3 p30 -32.53 98.18 0.12 Allowed Pre-proline 0 N--CA 1.469 0.522 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 -179.728 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -83.72 -101.73 0.0 OUTLIER 'Trans proline' 0 CA--C 1.536 0.598 0 C-N-CA 122.708 2.272 . . . . 0.0 112.348 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 175.47 132.08 0.15 Allowed Pre-proline 0 CA--C 1.531 0.228 0 O-C-N 122.343 -0.223 . . . . 0.0 110.875 179.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_exo -59.97 155.22 45.62 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.511 2.141 . . . . 0.0 112.41 179.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.412 ' HB2' ' CB ' ' A' ' 35' ' ' SER . 0.0 OUTLIER -97.5 -34.31 11.05 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.754 179.609 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.331 -0.215 0 CA-C-O 120.904 0.383 . . . . 0.0 110.725 179.725 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 192' ' ' CYS . . . . . 0.698 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.0 OUTLIER . . . . . 0 CA--C 1.499 -1.009 0 CA-C-O 121.629 0.728 . . . . 0.0 111.559 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 193' ' ' CYS . . . . . 0.698 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.0 OUTLIER 46.96 112.95 0.0 OUTLIER Pre-proline 0 C--N 1.315 -0.933 0 CA-C-N 113.552 -1.658 . . . . 0.0 112.512 173.636 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 194' ' ' PRO . . . . . . . . . . . . . 80.3 Cg_exo -42.22 162.88 0.04 OUTLIER 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.709 2.273 . . . . 0.0 112.622 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -94.34 -15.23 24.58 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.792 -179.45 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 196' ' ' THR . . . . . 0.58 ' C ' ' H ' ' B' ' 198' ' ' TYR . 27.3 p -122.02 40.3 0.44 Allowed Pre-proline 0 C--N 1.331 -0.235 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 197' ' ' PRO . . . . . 0.544 ' CD ' ' N ' ' B' ' 196' ' ' THR . 94.2 Cg_endo -76.25 15.39 0.99 Allowed 'Trans proline' 0 N--CA 1.458 -0.59 0 C-N-CA 121.757 1.638 . . . . 0.0 108.906 176.123 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 198' ' ' TYR . . . . . 0.58 ' H ' ' C ' ' B' ' 196' ' ' THR . 46.5 t80 . . . . . 0 C--O 1.249 1.066 0 CA-C-N 113.947 -1.479 . . . . 0.0 111.338 -178.811 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 27.4 mm . . . . . 0 N--CA 1.486 1.352 0 CA-C-O 120.761 0.315 . . . . 0.0 111.026 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . 0.406 HG22 ' N ' ' A' ' 3' ' ' CYS . 8.2 p -176.9 150.02 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.876 -179.908 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.483 ' C ' ' CG ' ' A' ' 4' ' ' HIS . 3.8 p -111.99 -28.12 8.15 Favored 'General case' 0 C--O 1.224 -0.252 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 -179.193 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' HIS . . . . . 0.483 ' CG ' ' C ' ' A' ' 3' ' ' CYS . 0.0 OUTLIER 57.67 162.27 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.892 0.377 . . . . 0.0 110.682 -179.495 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.4 m -96.4 35.93 1.42 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.485 -179.641 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.476 ' HB ' ' HB2' ' A' ' 66' ' ' ASN . 24.0 m -37.75 -34.5 0.11 Allowed 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.135 -179.919 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.432 ' O ' ' OG1' ' A' ' 8' ' ' THR . . . 34.79 80.66 0.02 OUTLIER 'General case' 0 N--CA 1.461 0.084 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.316 179.745 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.432 ' OG1' ' O ' ' A' ' 7' ' ' ALA . 1.9 p . . . . . 0 C--N 1.33 -0.252 0 CA-C-N 115.749 -0.659 . . . . 0.0 111.236 -179.546 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.56 ' N ' ' CD ' ' A' ' 18' ' ' PRO . 61.6 Cg_endo . . . . . 0 CA--C 1.541 0.839 0 N-CA-C 115.284 1.225 . . . . 0.0 115.284 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.56 ' CD ' ' N ' ' A' ' 17' ' ' PRO . 89.2 Cg_endo -82.96 -168.39 0.58 Allowed 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 121.659 1.572 . . . . 0.0 112.111 179.807 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -65.03 79.4 0.07 OUTLIER Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.55 -0.834 . . . . 0.0 111.967 179.669 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 66.42 118.08 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.903 0.382 . . . . 0.0 110.436 -179.47 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . 0.466 ' O ' ' HB2' ' A' ' 22' ' ' LEU . 1.7 t-20 -146.05 -63.21 0.32 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.668 -179.735 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.516 ' HG ' ' HB2' ' A' ' 48' ' ' CYS . 2.4 mm? 70.7 108.72 0.06 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.276 179.586 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.567 ' HA ' ' HA ' ' A' ' 44' ' ' CYS . 5.5 m -64.08 65.34 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 115.901 -0.591 . . . . 0.0 111.639 -179.784 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.466 ' CG ' ' CB ' ' A' ' 45' ' ' ALA . 0.1 OUTLIER -22.72 138.1 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 123.54 0.736 . . . . 0.0 112.639 179.985 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -128.29 110.38 12.33 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.536 -179.683 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 1.5 ptpt -114.14 114.28 25.84 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.298 179.265 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -137.49 97.59 3.5 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.975 0.417 . . . . 0.0 111.272 -179.656 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -70.21 -165.8 0.11 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.741 179.453 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . 0.426 ' HB3' ' HA ' ' A' ' 33' ' ' CYS . 0.0 OUTLIER -132.22 -167.53 1.9 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.863 -179.249 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -90.31 -49.64 6.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.174 -179.816 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -155.5 -75.31 0.1 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.382 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . 0.406 ' O ' ' CD2' ' A' ' 32' ' ' PHE . 33.7 t80 -90.44 14.08 13.94 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.42 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.426 ' HA ' ' HB3' ' A' ' 29' ' ' CYS . 93.9 m 48.84 79.67 0.07 Allowed 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.771 0.32 . . . . 0.0 111.088 -179.899 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 5.6 p -135.16 42.7 2.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.041 -179.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 60.84 35.22 19.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.014 179.831 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -129.76 31.08 4.79 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.871 179.889 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -104.81 -168.7 24.34 Favored Glycine 0 C--N 1.331 0.266 0 C-N-CA 120.83 -0.7 . . . . 0.0 112.643 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.243 0 CA-C-O 120.737 0.303 . . . . 0.0 111.048 -179.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.52 0.383 0 N-CA-C 114.407 0.523 . . . . 0.0 114.407 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.567 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 0.0 OUTLIER 57.32 157.87 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 117.373 0.587 . . . . 0.0 112.327 178.612 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.466 ' CB ' ' CG ' ' A' ' 24' ' ' TYR . . . -151.11 -39.27 0.12 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.465 -0.788 . . . . 0.0 111.466 -179.718 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.428 ' HA ' ' HA ' ' A' ' 21' ' ' ASN . . . 80.85 40.52 0.06 Allowed 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.975 -179.766 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 4.6 t -165.77 77.48 0.26 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.67 179.786 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.527 ' N ' ' HD2' ' A' ' 49' ' ' PRO . 52.9 t -69.07 -48.88 26.74 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.417 -179.737 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.527 ' HD2' ' N ' ' A' ' 48' ' ' CYS . 52.0 Cg_endo -69.89 58.95 1.66 Allowed 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 121.705 1.603 . . . . 0.0 110.04 178.628 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 42.8 t -110.0 -109.01 0.34 Allowed 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 114.977 -1.01 . . . . 0.0 111.057 -178.159 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 36.17 77.54 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.323 0 N-CA-C 112.149 0.425 . . . . 0.0 112.149 179.808 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.565 ' HB2' ' HD3' ' A' ' 53' ' ' PRO . 0.0 OUTLIER -104.26 -56.4 0.09 OUTLIER Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.611 179.366 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . 0.565 ' HD3' ' HB2' ' A' ' 52' ' ' LYS . 11.8 Cg_endo -93.29 171.23 2.07 Favored 'Trans proline' 0 N--CA 1.453 -0.908 0 C-N-CA 123.167 2.578 . . . . 0.0 111.749 179.69 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.469 0.487 0 CA-C-O 120.842 0.353 . . . . 0.0 110.722 179.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 89.0 m . . . . . 0 N--CA 1.454 -0.266 0 CA-C-O 120.655 0.264 . . . . 0.0 111.013 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . 0.404 ' CB ' ' HG ' ' A' ' 22' ' ' LEU . 0.6 OUTLIER -43.44 133.75 4.2 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.89 179.773 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . 0.554 ' HB2' ' O ' ' A' ' 23' ' ' CYS . 0.5 OUTLIER -114.97 -94.58 0.47 Allowed 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.905 -178.846 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.472 ' HB2' ' HA ' ' A' ' 22' ' ' LEU . 2.3 t 64.07 -76.48 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.79 0.329 . . . . 0.0 111.567 -179.848 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 9.3 t -44.22 134.05 5.07 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.135 -0.484 . . . . 0.0 112.044 -179.054 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 56.17 173.15 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.718 -0.673 . . . . 0.0 111.586 179.384 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.75 84.75 0.11 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.039 179.605 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -93.37 16.96 12.15 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.074 -0.512 . . . . 0.0 112.311 -178.705 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.481 ' ND2' ' O ' ' A' ' 3' ' ' CYS . 0.7 OUTLIER -54.04 163.16 1.25 Allowed Pre-proline 0 N--CA 1.465 0.275 0 CA-C-O 120.908 0.385 . . . . 0.0 111.15 179.841 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_exo -51.25 124.89 15.04 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.709 2.273 . . . . 0.0 112.307 179.78 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 11.8 m-70 -133.75 99.78 13.83 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.856 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -48.81 165.66 0.17 Allowed 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.571 2.181 . . . . 0.0 112.46 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.8 ptmt -114.83 -30.1 6.54 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.976 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 . . . . . 0 C--N 1.33 -0.247 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.37 179.866 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 192' ' ' CYS . . . . . 0.705 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.1 OUTLIER . . . . . 0 CA--C 1.5 -0.944 0 CA-C-O 121.506 0.67 . . . . 0.0 112.149 . . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 193' ' ' CYS . . . . . 0.705 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.0 OUTLIER -162.45 163.37 18.36 Favored Pre-proline 0 N--CA 1.436 -1.161 0 CA-C-N 114.278 -1.328 . . . . 0.0 111.752 -173.46 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 194' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -82.74 130.99 6.07 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.768 2.312 . . . . 0.0 112.051 179.604 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -63.84 80.81 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.02 -179.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 196' ' ' THR . . . . . 0.687 ' N ' ' CD ' ' B' ' 197' ' ' PRO . 0.7 OUTLIER -118.34 5.43 0.08 OUTLIER Pre-proline 0 C--N 1.328 -0.328 0 N-CA-C 113.763 1.023 . . . . 0.0 113.763 -179.636 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 197' ' ' PRO . . . . . 0.687 ' CD ' ' N ' ' B' ' 196' ' ' THR . 73.9 Cg_endo -74.04 21.93 0.37 Allowed 'Trans proline' 0 C--N 1.354 0.827 0 CA-C-N 120.53 1.225 . . . . 0.0 109.042 176.471 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 198' ' ' TYR . . . . . 0.653 ' H ' ' C ' ' B' ' 196' ' ' THR . 0.2 OUTLIER . . . . . 0 C--O 1.25 1.081 0 CA-C-N 114.058 -1.428 . . . . 0.0 111.379 -178.753 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 1' ' ' ILE . . . . . 0.444 HG23 HD12 ' A' ' 1' ' ' ILE . 0.1 OUTLIER . . . . . 0 N--CA 1.485 1.313 0 CA-C-O 120.94 0.4 . . . . 0.0 111.132 . . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 3.7 m -98.98 -171.02 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.735 179.751 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -148.14 88.33 1.65 Allowed 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 111.773 0.286 . . . . 0.0 111.773 -179.667 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' HIS . . . . . 0.481 ' CE1' ' HB2' ' A' ' 64' ' ' LYS . 4.9 p-80 -59.0 126.79 29.17 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.888 0.375 . . . . 0.0 110.23 179.299 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 75.0 p -47.21 -74.7 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.483 -179.395 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 63.8 p 50.45 23.82 1.39 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.928 179.656 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -120.38 -161.12 0.86 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.564 -0.289 . . . . 0.0 110.327 179.436 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 1.3 t . . . . . 0 N--CA 1.462 0.146 0 CA-C-O 120.869 0.366 . . . . 0.0 110.066 179.45 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_exo . . . . . 0 CA--C 1.529 0.263 0 N-CA-C 113.018 0.353 . . . . 0.0 113.018 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_exo -57.17 -160.25 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.724 2.283 . . . . 0.0 112.475 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 64.17 -86.67 0.07 OUTLIER Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.675 -0.774 . . . . 0.0 112.137 -179.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -105.07 142.32 35.06 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 110.252 -0.277 . . . . 0.0 110.252 179.53 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . 0.419 ' HB3' ' N ' ' A' ' 45' ' ' ALA . 1.5 m-20 64.14 88.86 0.1 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.437 -179.617 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.45 ' HG ' ' CB ' ' A' ' 61' ' ' SER . 0.6 OUTLIER -73.66 -80.32 0.07 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.478 -179.49 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 8.4 m -158.52 29.04 0.23 Allowed 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 120.602 0.239 . . . . 0.0 111.546 -178.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.469 ' CG ' ' N ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -83.49 161.93 21.09 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.075 0.464 . . . . 0.0 111.728 -178.973 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.469 ' N ' ' CG ' ' A' ' 24' ' ' TYR . 0.9 OUTLIER -168.73 -79.08 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 115.718 -0.673 . . . . 0.0 110.973 178.889 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 177.7 165.97 0.66 Allowed 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.646 0.26 . . . . 0.0 110.767 179.844 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -152.09 -167.18 2.69 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.143 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' TRP . . . . . 0.409 ' HA ' ' CE3' ' A' ' 28' ' ' TRP . 2.5 t-105 -148.38 179.02 8.1 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.447 179.756 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -173.59 99.32 0.11 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.837 0.351 . . . . 0.0 111.117 -179.901 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 50.2 t0 -66.05 137.51 57.13 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.555 179.728 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . 59.22 -156.29 0.34 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.524 -179.751 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 14.1 m-85 -82.59 53.11 2.25 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.823 0.344 . . . . 0.0 110.904 179.785 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 56.9 m 44.95 30.06 0.53 Allowed 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.308 -179.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 92.3 p -82.24 -31.67 30.09 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.62 179.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -130.15 114.67 16.01 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.621 179.78 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 33.1 mmm-85 -57.12 133.89 55.39 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.229 -179.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.411 ' C ' ' HG2' ' A' ' 38' ' ' LYS . . . -113.65 44.71 1.44 Allowed Glycine 0 C--N 1.33 0.248 0 C-N-CA 120.824 -0.703 . . . . 0.0 112.586 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.415 ' O ' ' HG3' ' A' ' 70' ' ' LYS . 0.2 OUTLIER . . . . . 0 CA--C 1.531 0.223 0 C-N-CA 122.218 0.207 . . . . 0.0 111.402 179.767 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . 0.411 ' N ' ' HB2' ' A' ' 25' ' ' ARG . . . . . . . . 0 N--CA 1.45 -0.388 0 N-CA-C 112.736 -0.146 . . . . 0.0 112.736 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 3.3 m 62.65 147.62 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.897 0.38 . . . . 0.0 111.333 179.249 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.419 ' N ' ' HB3' ' A' ' 21' ' ' ASN . . . 175.97 137.3 0.05 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.769 179.345 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -70.27 67.96 0.33 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.051 0.453 . . . . 0.0 110.795 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.438 HG21 ' N ' ' A' ' 48' ' ' CYS . 89.0 m -164.77 147.09 8.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.817 -179.62 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.438 ' N ' HG21 ' A' ' 47' ' ' THR . 0.1 OUTLIER -131.6 67.3 79.79 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.899 179.928 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.545 ' HA ' ' HG3' ' A' ' 52' ' ' LYS . 32.6 Cg_exo -60.94 -11.22 17.22 Favored 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 122.466 2.111 . . . . 0.0 111.659 178.943 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 32.4 t -39.33 -68.7 0.15 Allowed 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 115.598 -0.728 . . . . 0.0 112.336 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 16.6 ptmt -90.69 77.16 6.37 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 120.923 0.392 . . . . 0.0 111.718 -179.238 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.599 ' HB3' ' CD ' ' A' ' 53' ' ' PRO . 0.6 OUTLIER -148.34 -167.11 0.15 Allowed Pre-proline 0 CA--C 1.538 0.494 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 179.682 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . 0.599 ' CD ' ' HB3' ' A' ' 52' ' ' LYS . 76.0 Cg_exo -51.96 -142.33 0.0 OUTLIER 'Trans proline' 0 C--N 1.356 0.947 0 C-N-CA 122.445 2.097 . . . . 0.0 113.198 -179.461 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.471 0.585 0 CA-C-O 120.83 0.347 . . . . 0.0 111.782 -179.059 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 10.7 p . . . . . 0 C--O 1.232 0.14 0 CA-C-O 120.974 0.416 . . . . 0.0 110.14 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . 0.565 ' O ' ' CB ' ' A' ' 60' ' ' CYS . 80.4 m 56.06 -116.51 1.02 Allowed 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.802 -179.316 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . 0.565 ' CB ' ' O ' ' A' ' 59' ' ' CYS . 2.4 m 139.17 47.07 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.476 0.71 . . . . 0.0 109.889 179.401 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.45 ' CB ' ' HG ' ' A' ' 22' ' ' LEU . 79.3 p -115.73 160.55 19.94 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.334 -179.424 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 1.3 m 73.84 17.68 3.51 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.934 -0.576 . . . . 0.0 111.635 179.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.9 p30 171.18 167.93 0.08 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 120.687 0.28 . . . . 0.0 110.909 179.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.481 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 0.0 OUTLIER -56.96 -32.79 66.39 Favored 'General case' 0 CA--C 1.516 -0.352 0 CA-C-O 121.498 0.666 . . . . 0.0 110.913 179.827 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 43.6 t 72.32 -44.36 0.59 Allowed 'General case' 0 C--N 1.313 -0.986 0 CA-C-N 114.727 -1.124 . . . . 0.0 112.689 179.03 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.452 ' HB2' ' NE2' ' A' ' 4' ' ' HIS . 0.3 OUTLIER -40.07 97.35 0.13 Allowed Pre-proline 0 N--CA 1.47 0.543 0 CA-C-O 120.697 0.284 . . . . 0.0 111.532 -178.92 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . 0.459 ' O ' ' CG ' ' A' ' 68' ' ' HIS . 6.7 Cg_exo -73.88 -2.24 11.96 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.953 2.435 . . . . 0.0 112.711 -179.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.459 ' CG ' ' O ' ' A' ' 67' ' ' PRO . 3.4 p80 55.98 168.49 0.05 OUTLIER Pre-proline 0 CA--C 1.53 0.202 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.085 -179.824 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 77.2 Cg_exo -50.53 114.42 1.45 Allowed 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.531 2.154 . . . . 0.0 112.325 -179.869 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.415 ' HG3' ' O ' ' A' ' 38' ' ' LYS . 2.3 mtmm -61.52 -61.68 2.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.948 -179.925 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.412 ' HA ' ' CD ' ' A' ' 38' ' ' LYS . 1.3 tt0 . . . . . 0 CA--C 1.533 0.291 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.349 179.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 192' ' ' CYS . . . . . 0.687 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.0 OUTLIER . . . . . 0 CA--C 1.496 -1.113 0 CA-C-O 121.955 0.883 . . . . 0.0 111.352 . . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 193' ' ' CYS . . . . . 0.687 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.1 OUTLIER 40.02 89.53 0.08 OUTLIER Pre-proline 0 N--CA 1.439 -0.983 0 CA-C-N 113.23 -1.805 . . . . 0.0 112.257 173.774 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 194' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_exo -49.07 176.93 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.61 2.206 . . . . 0.0 112.375 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -65.55 76.27 0.07 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.121 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 196' ' ' THR . . . . . 0.683 ' N ' ' HD3' ' B' ' 197' ' ' PRO . 9.7 t -150.14 45.56 0.36 Allowed Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.934 179.862 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 197' ' ' PRO . . . . . 0.683 ' HD3' ' N ' ' B' ' 196' ' ' THR . 3.7 Cg_exo -76.27 13.55 1.3 Allowed 'Trans proline' 0 C--N 1.351 0.68 0 C-N-CA 121.797 1.665 . . . . 0.0 108.572 175.894 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 198' ' ' TYR . . . . . 0.581 ' H ' ' C ' ' B' ' 196' ' ' THR . 43.6 t80 . . . . . 0 C--O 1.249 1.075 0 CA-C-N 113.766 -1.561 . . . . 0.0 111.237 -178.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 2.8 pp . . . . . 0 N--CA 1.486 1.369 0 CA-C-O 120.789 0.328 . . . . 0.0 111.143 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 22.5 t -144.91 148.46 17.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.55 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -97.31 -156.79 0.55 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.776 179.81 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' HIS . . . . . 0.496 ' CD2' ' HA ' ' A' ' 64' ' ' LYS . 2.2 p80 -123.89 151.25 43.71 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 178.745 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 42.9 p -60.14 114.17 2.73 Favored 'General case' 0 N--CA 1.439 -0.979 0 CA-C-O 121.554 0.692 . . . . 0.0 111.974 -178.43 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 64.5 m -151.39 27.95 0.65 Allowed 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 114.706 -1.134 . . . . 0.0 108.835 178.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -39.31 -31.7 0.09 Allowed 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 115.346 -0.843 . . . . 0.0 112.357 -179.146 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 88.1 m . . . . . 0 C--N 1.329 -0.292 0 CA-C-O 120.78 0.324 . . . . 0.0 111.209 -179.796 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_endo . . . . . 0 CA--C 1.529 0.259 0 CA-C-O 120.654 0.189 . . . . 0.0 112.471 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_exo -48.78 162.25 0.4 Allowed 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.612 2.208 . . . . 0.0 112.28 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 62.69 124.15 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.621 -0.799 . . . . 0.0 112.175 -179.782 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER 61.33 59.57 1.9 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.107 0.48 . . . . 0.0 110.655 -179.809 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 16.5 p-10 -155.29 96.05 1.77 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.53 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.409 ' O ' ' N ' ' A' ' 61' ' ' SER . 59.2 mt -112.79 28.16 9.02 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.615 -179.493 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.546 ' O ' ' CB ' ' A' ' 60' ' ' CYS . 7.8 t 37.08 67.44 0.35 Allowed 'General case' 0 C--O 1.222 -0.373 0 CA-C-N 116.6 -0.273 . . . . 0.0 111.608 179.331 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.549 ' CG ' ' HB1' ' A' ' 45' ' ' ALA . 0.0 OUTLIER -84.25 170.49 13.66 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 121.204 0.526 . . . . 0.0 112.366 -179.002 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 174.57 150.75 0.09 Allowed 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.477 -179.67 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.584 ' O ' ' CB ' ' A' ' 27' ' ' MET . 0.1 OUTLIER -144.83 -83.48 0.14 Allowed 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 120.765 -0.374 . . . . 0.0 111.821 179.996 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' MET . . . . . 0.584 ' CB ' ' O ' ' A' ' 26' ' ' LYS . 5.7 ptt? 134.09 -144.84 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.989 0.916 . . . . 0.0 108.692 -179.155 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -169.9 170.46 7.71 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-O 120.71 0.29 . . . . 0.0 110.892 179.179 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 18.4 t -177.38 -77.05 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.919 179.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 170.41 -80.76 0.0 OUTLIER 'General case' 0 CA--C 1.529 0.17 0 CA-C-O 120.676 0.274 . . . . 0.0 110.992 179.875 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -161.97 -80.98 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.189 179.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 35.2 p90 -97.5 21.05 10.73 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.777 0.322 . . . . 0.0 111.087 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 2.3 p -75.51 125.28 28.71 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.0 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 5.5 m -62.92 -20.81 65.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.232 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 25.7 p -87.38 50.88 2.09 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.884 0.373 . . . . 0.0 111.013 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 4.6 ptt85 -67.04 81.87 0.12 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.97 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.413 ' HA3' ' HG2' ' A' ' 70' ' ' LYS . . . 163.31 -142.18 7.68 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.678 -0.773 . . . . 0.0 112.6 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.411 ' HD2' ' CD ' ' A' ' 70' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.332 -0.157 0 CA-C-O 120.523 0.202 . . . . 0.0 111.061 -179.745 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . 0.459 ' HA2' ' O ' ' A' ' 24' ' ' TYR . . . . . . . . 0 CA--C 1.52 0.359 0 N-CA-C 113.73 0.252 . . . . 0.0 113.73 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.478 ' O ' ' CE1' ' A' ' 24' ' ' TYR . 0.5 OUTLIER 59.59 129.06 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 112.392 0.516 . . . . 0.0 112.392 179.075 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.549 ' HB1' ' CG ' ' A' ' 24' ' ' TYR . . . -140.73 -164.27 1.7 Allowed 'General case' 0 N--CA 1.461 0.103 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.176 179.921 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -132.04 20.32 4.51 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.602 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.5 m -178.58 124.07 0.1 Allowed 'General case' 0 CA--C 1.53 0.194 0 CA-C-O 120.777 0.322 . . . . 0.0 110.89 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.639 ' O ' ' N ' ' A' ' 50' ' ' SER . 47.5 t -77.83 -55.92 1.16 Allowed Pre-proline 0 C--N 1.332 -0.186 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.813 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.52 ' HD2' ' N ' ' A' ' 48' ' ' CYS . 4.0 Cg_exo -40.22 81.76 0.01 OUTLIER 'Trans proline' 0 C--N 1.356 0.967 0 C-N-CA 122.627 2.218 . . . . 0.0 111.411 179.842 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.639 ' N ' ' O ' ' A' ' 48' ' ' CYS . 41.1 t -131.25 8.31 4.68 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.296 -0.865 . . . . 0.0 111.541 -178.083 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 8.9 mtmt -61.93 -19.2 62.46 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.236 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.521 ' HB3' ' HD2' ' A' ' 53' ' ' PRO . 0.0 OUTLIER -57.15 179.64 0.13 Allowed Pre-proline 0 C--N 1.331 -0.227 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.311 179.894 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . 0.521 ' HD2' ' HB3' ' A' ' 52' ' ' LYS . 97.8 Cg_exo -45.14 -45.72 14.3 Favored 'Trans proline' 0 C--N 1.349 0.587 0 C-N-CA 122.353 2.036 . . . . 0.0 112.484 -179.833 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . 0.464 ' CE2' ' HB2' ' A' ' 52' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.468 0.429 0 CA-C-O 121.065 0.459 . . . . 0.0 110.63 179.705 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 11.5 t . . . . . 0 C--O 1.232 0.164 0 N-CA-C 110.313 -0.254 . . . . 0.0 110.313 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 31.8 p -45.94 123.57 4.63 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 120.989 0.423 . . . . 0.0 111.381 -179.497 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . 0.546 ' CB ' ' O ' ' A' ' 23' ' ' CYS . 0.1 OUTLIER -131.25 44.55 2.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.423 -179.707 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.409 ' N ' ' O ' ' A' ' 22' ' ' LEU . 8.8 p -80.81 132.2 35.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.355 -179.41 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 1.2 m 177.21 -74.4 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.159 179.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 67.9 t0 179.99 -37.76 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.595 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.496 ' HA ' ' CD2' ' A' ' 4' ' ' HIS . 1.5 mtpt -131.1 79.09 1.87 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.607 179.83 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . 0.467 ' HB3' ' HB3' ' A' ' 60' ' ' CYS . 0.0 OUTLIER -137.98 7.0 2.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.875 -179.718 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.472 ' HB2' ' HD2' ' A' ' 67' ' ' PRO . 0.1 OUTLIER -57.61 166.63 1.68 Allowed Pre-proline 0 N--CA 1.462 0.162 0 CA-C-O 120.493 0.187 . . . . 0.0 110.695 -179.991 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . 0.472 ' HD2' ' HB2' ' A' ' 66' ' ' ASN . 88.6 Cg_exo -44.72 162.96 0.07 OUTLIER 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.409 2.073 . . . . 0.0 112.161 179.688 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -176.24 64.05 0.22 Allowed Pre-proline 0 C--N 1.326 -0.427 0 CA-C-O 120.894 0.378 . . . . 0.0 111.068 -179.605 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -49.57 129.59 23.75 Favored 'Trans proline' 0 C--N 1.344 0.31 0 C-N-CA 122.594 2.196 . . . . 0.0 111.751 179.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.503 ' O ' ' C ' ' A' ' 71' ' ' GLN . 0.4 OUTLIER -69.94 -47.25 63.12 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 120.836 -0.346 . . . . 0.0 111.564 -179.231 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.503 ' C ' ' O ' ' A' ' 70' ' ' LYS . 2.2 tt0 . . . . . 0 N--CA 1.471 0.616 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 179.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 192' ' ' CYS . . . . . 0.685 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.1 OUTLIER . . . . . 0 CA--C 1.499 -0.993 0 CA-C-O 122.252 1.025 . . . . 0.0 111.972 . . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 193' ' ' CYS . . . . . 0.685 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.1 OUTLIER 36.27 92.71 0.05 OUTLIER Pre-proline 0 C--N 1.314 -0.955 0 CA-C-N 112.795 -2.002 . . . . 0.0 113.119 173.394 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 194' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -59.27 145.03 99.1 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.592 2.195 . . . . 0.0 112.042 179.549 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 78.6 m-20 -131.35 12.17 5.0 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.515 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 196' ' ' THR . . . . . 0.595 ' C ' ' H ' ' B' ' 198' ' ' TYR . 0.2 OUTLIER -122.26 35.4 0.26 Allowed Pre-proline 0 C--N 1.33 -0.27 0 N-CA-C 112.096 0.406 . . . . 0.0 112.096 179.873 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 197' ' ' PRO . . . . . 0.59 ' CD ' ' N ' ' B' ' 196' ' ' THR . 77.9 Cg_endo -74.73 15.7 0.68 Allowed 'Trans proline' 0 C--N 1.35 0.638 0 C-N-CA 121.551 1.501 . . . . 0.0 108.967 176.203 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 198' ' ' TYR . . . . . 0.595 ' H ' ' C ' ' B' ' 196' ' ' THR . 7.9 t80 . . . . . 0 C--O 1.249 1.028 0 CA-C-N 114.033 -1.44 . . . . 0.0 111.25 -178.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 1' ' ' ILE . . . . . 0.427 ' O ' ' CG2' ' A' ' 2' ' ' VAL . 5.1 mp . . . . . 0 N--CA 1.485 1.322 0 CA-C-O 120.421 0.153 . . . . 0.0 111.13 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . 0.427 ' CG2' ' O ' ' A' ' 1' ' ' ILE . 33.3 m 45.82 -179.34 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.312 0 CA-C-O 120.897 0.379 . . . . 0.0 111.865 -179.788 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 55.9 m -128.78 -139.76 0.24 Allowed 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.999 -179.165 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' HIS . . . . . 0.431 ' CE1' ' ND2' ' A' ' 66' ' ' ASN . 0.3 OUTLIER -109.48 -95.77 0.4 Allowed 'General case' 0 CA--C 1.53 0.188 0 O-C-N 122.406 -0.184 . . . . 0.0 110.53 179.926 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.3 t -145.13 145.66 31.48 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.974 0.416 . . . . 0.0 110.916 179.396 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 9.6 p -103.19 77.92 1.58 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.892 -179.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -177.96 -68.67 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.174 -179.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.797 -179.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.461 ' N ' ' HD2' ' A' ' 18' ' ' PRO . 35.6 Cg_exo . . . . . 0 CA--C 1.531 0.37 0 N-CA-C 113.42 0.508 . . . . 0.0 113.42 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.461 ' HD2' ' N ' ' A' ' 17' ' ' PRO . 37.3 Cg_exo -38.2 -44.08 1.88 Allowed 'Trans proline' 0 C--N 1.349 0.593 0 C-N-CA 122.918 2.412 . . . . 0.0 113.401 -179.259 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -107.93 -136.22 7.89 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.476 -0.868 . . . . 0.0 113.143 -179.692 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.557 ' CB ' ' HA ' ' A' ' 46' ' ' ALA . 0.3 OUTLIER -35.71 -42.94 0.27 Allowed 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 112.937 0.717 . . . . 0.0 112.937 -179.347 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . 0.425 ' N ' ' HG2' ' A' ' 20' ' ' GLU . 0.1 OUTLIER 79.19 -52.52 0.44 Allowed 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 114.845 -1.07 . . . . 0.0 110.926 -179.398 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.758 ' O ' ' HA ' ' A' ' 44' ' ' CYS . 0.4 OUTLIER -59.72 118.25 5.93 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 179.368 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.533 ' HA ' ' HA ' ' A' ' 44' ' ' CYS . 6.0 m -80.44 39.7 0.47 Allowed 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 113.091 0.775 . . . . 0.0 113.091 -178.514 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.51 ' O ' ' HB2' ' A' ' 60' ' ' CYS . 0.1 OUTLIER 43.67 -165.58 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.375 0 CA-C-O 120.71 0.29 . . . . 0.0 111.204 179.55 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.438 ' CB ' HG23 ' A' ' 58' ' ' THR . 0.1 OUTLIER -179.97 90.2 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.979 -0.288 . . . . 0.0 111.615 179.717 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 4.8 mtmt -84.09 110.82 18.78 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.796 179.538 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 1.6 ttp -131.03 92.2 3.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.312 -179.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' TRP . . . . . 0.404 ' CZ3' ' O ' ' A' ' 54' ' ' TYR . 0.0 OUTLIER -67.12 -159.81 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.409 179.574 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 93.5 m -148.94 157.54 43.5 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.852 0.358 . . . . 0.0 110.986 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -137.71 121.02 16.97 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.676 179.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.427 ' C ' ' CG ' ' A' ' 32' ' ' PHE . . . 62.22 90.39 0.07 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.814 -179.717 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . 0.427 ' CG ' ' C ' ' A' ' 31' ' ' ALA . 4.6 p90 44.48 30.11 0.46 Allowed 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.361 -179.79 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 9.2 t 43.55 55.75 4.78 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.37 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -156.74 28.38 0.32 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.657 179.803 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.429 ' O ' ' C ' ' A' ' 36' ' ' ARG . 43.2 m -138.24 37.86 2.3 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.585 -179.891 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.429 ' C ' ' O ' ' A' ' 35' ' ' SER . 0.2 OUTLIER 25.84 89.77 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 115.739 -0.664 . . . . 0.0 112.275 179.55 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.414 ' N ' ' HG3' ' A' ' 70' ' ' LYS . . . -80.06 -127.33 0.66 Allowed Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.639 -0.791 . . . . 0.0 113.315 -179.557 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.338 0 CA-C-O 120.947 0.404 . . . . 0.0 110.211 -179.302 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.515 0.089 0 N-CA-C 113.678 0.231 . . . . 0.0 113.678 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.758 ' HA ' ' O ' ' A' ' 22' ' ' LEU . 59.2 m 61.99 141.26 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.887 0.344 . . . . 0.0 111.348 179.191 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.488 ' N ' ' HG3' ' A' ' 20' ' ' GLU . . . -130.0 -99.57 0.33 Allowed 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 112.042 0.386 . . . . 0.0 112.042 -179.557 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.557 ' HA ' ' CB ' ' A' ' 20' ' ' GLU . . . -179.33 -41.4 0.01 OUTLIER 'General case' 0 C--O 1.23 0.057 0 CA-C-O 120.906 0.384 . . . . 0.0 110.958 -179.368 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 4.7 t -178.12 45.65 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.118 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.461 ' N ' ' HD3' ' A' ' 49' ' ' PRO . 10.1 m 55.68 62.9 6.78 Favored Pre-proline 0 C--N 1.332 -0.195 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.374 179.733 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.461 ' HD3' ' N ' ' A' ' 48' ' ' CYS . 5.4 Cg_exo -76.47 3.9 5.96 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.755 2.303 . . . . 0.0 111.502 178.862 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.482 ' O ' ' HB2' ' A' ' 51' ' ' LYS . 30.3 t -51.05 -62.55 1.55 Allowed 'General case' 0 N--CA 1.455 -0.195 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.519 -179.804 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.482 ' HB2' ' O ' ' A' ' 50' ' ' SER . 9.5 mtpt 77.87 -50.28 0.5 Allowed 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.483 -179.729 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.36 133.16 20.72 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.003 -179.739 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 69.2 Cg_endo -76.16 -47.94 0.15 Allowed 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.534 2.156 . . . . 0.0 112.612 -179.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . 0.404 ' O ' ' CZ3' ' A' ' 28' ' ' TRP . 0.0 OUTLIER . . . . . 0 N--CA 1.47 0.536 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.101 -179.911 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.438 HG23 ' CB ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER . . . . . 0 CA--C 1.534 0.339 0 CA-C-O 120.217 0.056 . . . . 0.0 110.992 . . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -151.11 160.15 44.06 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 120.94 0.4 . . . . 0.0 111.315 -179.699 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . 0.51 ' HB2' ' O ' ' A' ' 24' ' ' TYR . 0.1 OUTLIER -138.7 -18.59 1.07 Allowed 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.609 179.846 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 83.1 p -42.8 106.33 0.06 Allowed 'General case' 0 N--CA 1.462 0.17 0 CA-C-O 120.843 0.354 . . . . 0.0 111.859 -179.503 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 4.0 p -164.84 -76.45 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.601 179.646 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . 0.421 ' HA ' HG23 ' A' ' 1' ' ' ILE . 30.6 p-10 177.58 -39.31 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.704 179.821 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.414 ' O ' ' ND2' ' A' ' 66' ' ' ASN . 0.0 OUTLIER -160.81 56.52 0.31 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.998 -0.547 . . . . 0.0 110.486 179.712 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . 0.426 ' O ' ' C ' ' A' ' 66' ' ' ASN . 1.3 p -55.12 -62.73 1.47 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.366 -179.499 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.431 ' ND2' ' CE1' ' A' ' 4' ' ' HIS . 9.2 p30 29.69 62.02 0.86 Allowed Pre-proline 0 N--CA 1.468 0.466 0 C-N-CA 122.625 0.37 . . . . 0.0 111.962 -179.78 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_exo -52.35 -57.21 2.24 Favored 'Trans proline' 0 C--N 1.343 0.274 0 C-N-CA 122.651 2.234 . . . . 0.0 112.8 -179.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.463 ' HB3' ' HD2' ' A' ' 69' ' ' PRO . 15.7 m170 62.34 161.01 0.12 Allowed Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.349 -179.671 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . 0.463 ' HD2' ' HB3' ' A' ' 68' ' ' HIS . 67.7 Cg_exo -36.23 126.07 0.37 Allowed 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 123.046 2.497 . . . . 0.0 112.791 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.414 ' HG3' ' N ' ' A' ' 37' ' ' GLY . 0.0 OUTLIER -57.44 -16.9 10.68 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.288 -179.977 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.332 -0.179 0 CA-C-O 120.969 0.414 . . . . 0.0 110.736 179.652 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 192' ' ' CYS . . . . . 0.7 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.5 OUTLIER . . . . . 0 CA--C 1.501 -0.939 0 CA-C-O 121.965 0.888 . . . . 0.0 112.296 . . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 193' ' ' CYS . . . . . 0.7 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.0 OUTLIER -150.28 107.73 3.17 Favored Pre-proline 0 N--CA 1.434 -1.227 0 CA-C-N 113.492 -1.685 . . . . 0.0 111.903 -173.736 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 194' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -76.36 178.47 7.49 Favored 'Trans proline' 0 C--N 1.348 0.522 0 C-N-CA 122.545 2.163 . . . . 0.0 112.054 179.735 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 4.8 t0 55.06 100.18 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.916 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 196' ' ' THR . . . . . 0.719 ' N ' ' HD3' ' B' ' 197' ' ' PRO . 1.8 t -112.08 20.57 0.07 OUTLIER Pre-proline 0 CA--C 1.533 0.293 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 -179.783 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 197' ' ' PRO . . . . . 0.719 ' HD3' ' N ' ' B' ' 196' ' ' THR . 6.6 Cg_exo -68.52 19.43 0.14 Allowed 'Trans proline' 0 C--N 1.358 1.068 0 CA-C-N 120.382 1.172 . . . . 0.0 109.6 176.302 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 198' ' ' TYR . . . . . 0.68 ' H ' ' C ' ' B' ' 196' ' ' THR . 64.9 t80 . . . . . 0 C--O 1.249 1.046 0 CA-C-N 114.535 -1.211 . . . . 0.0 111.248 -178.828 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 1' ' ' ILE . . . . . 0.414 ' CG2' ' HB2' ' A' ' 63' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.445 0 CA-C-O 120.827 0.346 . . . . 0.0 110.989 . . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . 0.449 ' O ' ' HB3' ' A' ' 63' ' ' ASP . 48.9 t -125.7 133.27 69.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.796 179.629 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.517 ' O ' ' C ' ' A' ' 4' ' ' HIS . 19.4 m -92.33 65.22 4.53 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -178.545 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' HIS . . . . . 0.517 ' C ' ' O ' ' A' ' 3' ' ' CYS . 0.5 OUTLIER -10.49 93.03 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 112.651 0.611 . . . . 0.0 112.651 179.596 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.422 ' O ' ' O ' ' A' ' 4' ' ' HIS . 0.0 OUTLIER 39.24 -166.07 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 115.951 -0.568 . . . . 0.0 112.042 179.492 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.46 ' O ' ' CB ' ' A' ' 7' ' ' ALA . 3.9 t -99.25 23.31 9.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.712 179.836 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.46 ' CB ' ' O ' ' A' ' 6' ' ' THR . . . 86.87 -31.3 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.624 -179.847 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.33 -0.243 0 CA-C-O 120.673 0.273 . . . . 0.0 111.149 -179.824 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo . . . . . 0 CA--C 1.527 0.146 0 N-CA-C 112.861 0.293 . . . . 0.0 112.861 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -82.16 -57.83 0.03 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.55 0 C-N-CA 122.993 2.462 . . . . 0.0 111.451 179.494 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -124.98 -40.81 0.4 Allowed Glycine 0 N--CA 1.45 -0.421 0 CA-C-N 115.836 -0.62 . . . . 0.0 112.009 179.559 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 24.9 tp10 -160.11 68.33 0.38 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.897 0.38 . . . . 0.0 110.83 179.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -140.95 83.51 1.89 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.045 -179.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.469 ' HB3' ' CB ' ' A' ' 61' ' ' SER . 47.2 mt -52.29 151.54 3.9 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.814 0.34 . . . . 0.0 111.11 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.557 ' HA ' ' HA ' ' A' ' 44' ' ' CYS . 5.3 t -78.66 167.91 20.53 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.6 179.845 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.497 ' N ' ' HA ' ' A' ' 44' ' ' CYS . 0.2 OUTLIER -121.49 -176.31 3.27 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-O 120.737 0.303 . . . . 0.0 110.902 179.851 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 4.5 ttm180 -176.28 97.76 0.06 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.254 179.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 2.7 mtpt -80.65 148.23 30.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.298 179.487 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -154.17 98.61 2.16 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.835 0.35 . . . . 0.0 111.605 -179.796 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 1.8 t90 -77.86 -144.68 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.32 179.409 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 38.5 t -176.71 -36.4 0.01 OUTLIER 'General case' 0 C--O 1.231 0.083 0 CA-C-O 120.744 0.307 . . . . 0.0 111.11 -179.814 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 1.6 t70 77.84 -61.46 0.4 Allowed 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.906 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -174.24 96.17 0.09 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.884 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER 58.88 104.62 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.405 -179.627 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -112.41 -83.56 0.59 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.277 -179.645 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 4.1 p 70.09 -60.22 0.49 Allowed 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.765 0.317 . . . . 0.0 110.639 -179.574 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -110.51 -21.77 11.99 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.964 179.794 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.59 -86.19 0.03 OUTLIER 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 116.627 -0.261 . . . . 0.0 110.945 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.403 ' O ' ' C ' ' A' ' 38' ' ' LYS . . . 73.84 -88.48 0.65 Allowed Glycine 0 C--N 1.334 0.455 0 C-N-CA 120.467 -0.873 . . . . 0.0 112.741 179.896 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.437 ' HB3' ' HB2' ' A' ' 70' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.467 0.382 0 CA-C-O 121.065 0.46 . . . . 0.0 111.872 -179.826 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.325 0 CA-C-O 120.083 -0.287 . . . . 0.0 113.376 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.557 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 0.5 OUTLIER 61.44 131.83 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.169 0.509 . . . . 0.0 111.847 179.345 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.457 ' CB ' ' CE1' ' A' ' 24' ' ' TYR . . . -104.29 -171.83 2.0 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.895 179.861 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -120.54 -16.24 8.35 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 112.117 0.414 . . . . 0.0 112.117 -179.716 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 5.1 t -160.76 26.51 0.15 Allowed 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 111.902 0.334 . . . . 0.0 111.902 -179.784 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER 51.6 53.6 13.48 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-O 120.686 0.279 . . . . 0.0 111.06 179.583 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -70.41 58.88 1.91 Allowed 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.285 1.99 . . . . 0.0 110.338 178.606 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 36.3 t -130.12 133.3 46.55 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.474 -0.784 . . . . 0.0 111.024 -178.364 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 175.22 46.08 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.799 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -127.96 164.17 38.73 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.707 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -54.91 -162.97 0.01 OUTLIER 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.725 2.283 . . . . 0.0 112.268 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.472 0.645 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.378 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 11.6 t . . . . . 0 CA--C 1.528 0.106 0 CA-C-O 120.801 0.334 . . . . 0.0 110.906 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 10.8 m 60.02 110.92 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.179 179.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . 0.478 ' HB3' ' C ' ' A' ' 23' ' ' CYS . 46.9 t -100.29 35.27 2.13 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.422 179.599 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.544 ' O ' ' OG1' ' A' ' 62' ' ' THR . 52.9 p -60.79 80.25 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.117 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.73 -180.0 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' THR . . . . . 0.544 ' OG1' ' O ' ' A' ' 61' ' ' SER . 55.0 m 179.47 -33.24 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.364 -0.835 . . . . 0.0 109.384 -179.77 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . 0.475 ' HB2' ' O ' ' A' ' 62' ' ' THR . 0.8 OUTLIER 70.63 60.91 0.2 Allowed 'General case' 0 C--O 1.23 0.077 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.724 179.548 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.476 ' HA ' ' CE1' ' A' ' 4' ' ' HIS . 5.5 ptmm? 178.82 39.71 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.647 179.267 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 2.3 m -103.01 17.71 23.41 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.04 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 6.6 p-10 -137.55 87.1 17.94 Favored Pre-proline 0 C--N 1.332 -0.186 0 CA-C-O 120.727 0.299 . . . . 0.0 111.481 -179.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -79.61 -42.32 0.17 Allowed 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.687 2.258 . . . . 0.0 112.041 179.71 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 53.6 m80 -133.28 162.03 60.17 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.534 179.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_exo -49.39 -63.75 0.27 Allowed 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.414 2.076 . . . . 0.0 112.615 -179.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.437 ' HB2' ' HB3' ' A' ' 38' ' ' LYS . 0.0 OUTLIER -88.57 -159.19 0.53 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.834 -179.809 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 39.9 tt0 . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.803 179.918 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 192' ' ' CYS . . . . . 0.719 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.0 OUTLIER . . . . . 0 CA--C 1.5 -0.962 0 CA-C-O 122.015 0.912 . . . . 0.0 112.198 . . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 193' ' ' CYS . . . . . 0.719 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.0 OUTLIER 47.18 82.45 0.23 Allowed Pre-proline 0 N--CA 1.438 -1.037 0 CA-C-N 113.466 -1.697 . . . . 0.0 111.945 173.799 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 194' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -53.81 172.55 0.25 Allowed 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.677 2.251 . . . . 0.0 112.482 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 195' ' ' ASP . . . . . 0.402 ' HB2' ' CD ' ' B' ' 197' ' ' PRO . 8.5 m-20 -71.6 -161.83 0.07 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.815 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 196' ' ' THR . . . . . 0.783 ' C ' ' H ' ' B' ' 198' ' ' TYR . 41.5 p -89.83 -5.17 0.1 Allowed Pre-proline 0 CA--C 1.532 0.256 0 N-CA-C 113.793 1.034 . . . . 0.0 113.793 -179.337 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 197' ' ' PRO . . . . . 0.669 ' CD ' ' N ' ' B' ' 196' ' ' THR . 22.8 Cg_exo -62.29 20.98 0.05 OUTLIER 'Trans proline' 0 C--N 1.357 1.014 0 CA-C-N 120.944 1.373 . . . . 0.0 110.282 177.327 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 198' ' ' TYR . . . . . 0.783 ' H ' ' C ' ' B' ' 196' ' ' THR . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.056 0 CA-C-N 114.713 -1.13 . . . . 0.0 110.931 -179.342 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 1.7 mp . . . . . 0 N--CA 1.486 1.341 0 CA-C-O 120.953 0.406 . . . . 0.0 111.139 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -160.87 178.15 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.191 -179.914 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 4.6 m -67.82 -159.7 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.252 179.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' HIS . . . . . 0.457 ' CE1' ' ND2' ' A' ' 66' ' ' ASN . 0.0 OUTLIER -156.84 142.05 17.28 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-O 121.263 0.554 . . . . 0.0 112.122 179.978 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.427 ' C ' ' H ' ' A' ' 7' ' ' ALA . 13.4 p -53.98 -31.03 49.48 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.428 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.56 -6.55 1.14 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.61 179.188 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.427 ' H ' ' C ' ' A' ' 5' ' ' THR . . . -73.0 132.62 43.63 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.199 179.945 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 89.4 m . . . . . 0 C--N 1.331 -0.206 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.077 179.862 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.489 ' HB2' ' HD3' ' A' ' 18' ' ' PRO . 38.6 Cg_exo . . . . . 0 CA--C 1.53 0.276 0 N-CA-C 112.83 0.281 . . . . 0.0 112.83 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.489 ' HD3' ' HB2' ' A' ' 17' ' ' PRO . 89.3 Cg_endo -81.46 -171.82 1.32 Allowed 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.499 2.133 . . . . 0.0 112.412 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -112.73 144.5 17.97 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.175 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 58.14 72.25 0.53 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.921 0.391 . . . . 0.0 110.65 -179.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -119.86 -7.34 10.0 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.647 -179.353 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.588 HD22 ' HA ' ' A' ' 61' ' ' SER . 1.5 mt 61.88 88.33 0.09 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.53 0.205 . . . . 0.0 110.838 179.773 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.437 ' O ' ' HB2' ' A' ' 60' ' ' CYS . 1.7 t -59.5 73.94 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.494 -179.794 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.495 ' CE1' ' HB3' ' A' ' 45' ' ' ALA . 0.0 OUTLIER -114.97 156.59 24.78 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.843 -179.069 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 2.8 ttt180 -144.7 -81.09 0.17 Allowed 'General case' 0 CA--C 1.53 0.208 0 CA-C-O 120.836 0.35 . . . . 0.0 111.559 179.146 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 2.8 mtmm -179.77 110.52 0.04 OUTLIER 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.318 -179.725 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -89.19 122.54 32.58 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.843 -179.586 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -87.58 -179.86 6.4 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.856 0.36 . . . . 0.0 110.986 179.966 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 8.4 m -158.93 -178.04 6.95 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.798 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -109.24 -75.75 0.62 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.842 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -127.37 -70.07 0.72 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.975 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 37.6 t80 -102.27 -29.34 11.74 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.848 179.821 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 62.23 85.62 0.12 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.786 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 11.4 p -98.97 -57.57 2.14 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.976 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 2.3 p -135.11 31.69 3.22 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.991 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 2.8 mtt85 -107.84 -81.41 0.56 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.872 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 49.83 39.37 32.06 Favored Glycine 0 C--N 1.331 0.271 0 C-N-CA 120.818 -0.706 . . . . 0.0 112.775 179.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.529 ' HA ' ' HG2' ' A' ' 70' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.306 0 CA-C-O 120.712 0.291 . . . . 0.0 111.068 -179.814 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . 0.432 ' N ' ' O ' ' A' ' 24' ' ' TYR . . . . . . . . 0 N--CA 1.45 -0.387 0 N-CA-C 112.509 -0.236 . . . . 0.0 112.509 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.468 ' HA ' ' O ' ' A' ' 22' ' ' LEU . 0.7 OUTLIER 59.25 129.86 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.197 0 N-CA-C 113.362 0.875 . . . . 0.0 113.362 178.528 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.495 ' HB3' ' CE1' ' A' ' 24' ' ' TYR . . . -152.92 113.27 4.02 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.091 -0.959 . . . . 0.0 110.237 178.76 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -60.75 78.61 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.97 -179.316 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.442 ' OG1' ' HD3' ' A' ' 49' ' ' PRO . 0.0 OUTLIER 167.71 -77.61 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.688 179.331 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.437 ' N ' ' HD3' ' A' ' 49' ' ' PRO . 0.0 OUTLIER 47.41 63.1 10.75 Favored Pre-proline 0 C--O 1.233 0.209 0 CA-C-O 120.991 0.424 . . . . 0.0 111.944 179.353 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.442 ' HD3' ' OG1' ' A' ' 47' ' ' THR . 74.2 Cg_endo -94.84 11.45 1.62 Allowed 'Trans proline' 0 N--CA 1.451 -1.029 0 C-N-CA 123.371 2.714 . . . . 0.0 110.99 178.62 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 46.2 t -61.89 142.11 57.59 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 115.289 -0.869 . . . . 0.0 111.731 -179.241 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 6.9 mttm -164.94 54.1 0.12 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.178 179.718 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.46 ' CB ' ' HD2' ' A' ' 53' ' ' PRO . 0.0 OUTLIER -112.73 168.37 7.79 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.931 -179.525 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . 0.46 ' HD2' ' CB ' ' A' ' 52' ' ' LYS . 12.5 Cg_endo -55.81 -162.05 0.01 OUTLIER 'Trans proline' 0 C--N 1.348 0.536 0 C-N-CA 122.778 2.318 . . . . 0.0 112.375 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.47 0.541 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.177 -179.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 60.1 p . . . . . 0 CA--C 1.53 0.175 0 CA-C-O 120.845 0.355 . . . . 0.0 110.498 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . 0.458 ' HA ' ' CB ' ' A' ' 24' ' ' TYR . 5.4 m 69.19 103.94 0.06 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.864 179.767 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . 0.45 ' O ' ' HB3' ' A' ' 22' ' ' LEU . 0.0 OUTLIER -74.37 -160.39 0.1 Allowed 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.703 179.831 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.588 ' HA ' HD22 ' A' ' 22' ' ' LEU . 0.0 OUTLIER 167.72 137.69 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 120.958 0.409 . . . . 0.0 111.623 179.518 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER 35.09 -91.66 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 115.474 -0.784 . . . . 0.0 112.158 179.318 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . 0.41 ' O ' ' N ' ' A' ' 65' ' ' CYS . 9.3 p-10 -55.82 125.64 22.19 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.84 0.353 . . . . 0.0 111.257 -179.689 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 3.3 pttp -56.32 86.98 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.654 179.796 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . 0.41 ' N ' ' O ' ' A' ' 63' ' ' ASP . 0.1 OUTLIER -77.24 58.69 1.66 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.297 -179.641 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.556 ' N ' ' HD3' ' A' ' 67' ' ' PRO . 1.0 OUTLIER -167.06 55.87 0.34 Allowed Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.756 179.24 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . 0.556 ' HD3' ' N ' ' A' ' 66' ' ' ASN . 26.2 Cg_exo -62.03 -65.67 0.06 OUTLIER 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 122.516 2.144 . . . . 0.0 112.41 -179.782 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -110.85 158.32 36.06 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.757 -179.838 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 7.9 Cg_exo -71.09 -74.63 0.01 OUTLIER 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.643 2.229 . . . . 0.0 112.314 -179.691 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.579 ' HD2' ' N ' ' A' ' 70' ' ' LYS . 0.0 OUTLIER 177.41 -102.16 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 116.686 -0.234 . . . . 0.0 111.396 -179.969 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 37.3 tp60 . . . . . 0 C--O 1.231 0.086 0 CA-C-O 120.713 0.292 . . . . 0.0 111.216 -179.572 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 192' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.504 -0.811 0 CA-C-O 122.03 0.919 . . . . 0.0 112.347 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 193' ' ' CYS . . . . . 0.48 ' N ' ' HD3' ' B' ' 194' ' ' PRO . 0.6 OUTLIER 31.24 58.42 1.07 Allowed Pre-proline 0 N--CA 1.438 -1.049 0 CA-C-N 112.782 -2.008 . . . . 0.0 113.209 172.609 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 194' ' ' PRO . . . . . 0.48 ' HD3' ' N ' ' B' ' 193' ' ' CYS . 57.1 Cg_endo -90.53 -68.31 0.01 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.801 0 C-N-CA 122.779 2.319 . . . . 0.0 112.502 179.9 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 178.94 129.77 0.07 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.84 0.352 . . . . 0.0 110.801 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 196' ' ' THR . . . . . 0.661 ' N ' ' HD3' ' B' ' 197' ' ' PRO . 11.4 t -139.4 46.2 1.04 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.95 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 197' ' ' PRO . . . . . 0.661 ' HD3' ' N ' ' B' ' 196' ' ' THR . 5.7 Cg_exo -73.54 12.62 0.84 Allowed 'Trans proline' 0 C--N 1.35 0.639 0 C-N-CA 121.688 1.592 . . . . 0.0 108.699 175.963 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 198' ' ' TYR . . . . . 0.58 ' H ' ' C ' ' B' ' 196' ' ' THR . 8.2 t80 . . . . . 0 C--O 1.249 1.076 0 CA-C-N 113.963 -1.471 . . . . 0.0 111.273 -178.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 1' ' ' ILE . . . . . 0.416 HD13 HG22 ' A' ' 1' ' ' ILE . 29.0 mm . . . . . 0 N--CA 1.486 1.369 0 CA-C-O 120.729 0.299 . . . . 0.0 111.07 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 3.6 p -172.37 170.69 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.002 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.406 ' HB2' ' ND2' ' A' ' 66' ' ' ASN . 1.4 p -113.3 -162.14 0.79 Allowed 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 116.649 -0.25 . . . . 0.0 111.112 -179.521 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' HIS . . . . . 0.459 ' CE1' ' HB3' ' A' ' 66' ' ' ASN . 1.6 p80 -146.3 -175.96 4.98 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.874 0.369 . . . . 0.0 111.089 -179.851 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -97.9 80.97 2.8 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.69 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 96.7 m -89.77 -3.68 58.04 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.826 179.705 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -79.4 131.66 36.16 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.738 0.304 . . . . 0.0 110.828 179.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 5.1 p . . . . . 0 C--N 1.328 -0.332 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.696 -179.647 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.565 ' N ' ' HD2' ' A' ' 18' ' ' PRO . 6.8 Cg_endo . . . . . 0 CA--C 1.535 0.532 0 N-CA-C 113.843 0.67 . . . . 0.0 113.843 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.565 ' HD2' ' N ' ' A' ' 17' ' ' PRO . 12.3 Cg_endo -55.83 -80.34 0.02 OUTLIER 'Trans proline' 0 C--N 1.349 0.582 0 C-N-CA 122.186 1.924 . . . . 0.0 112.733 -179.162 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -151.8 -148.31 4.8 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.49 -0.862 . . . . 0.0 112.65 -179.789 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 58.36 -179.39 0.07 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.798 0.332 . . . . 0.0 110.663 -179.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 14.0 p30 -177.25 39.29 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.898 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -146.72 81.67 1.56 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.758 179.935 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.735 ' HA ' ' H ' ' A' ' 44' ' ' CYS . 6.5 m -58.02 120.66 8.95 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.994 -179.698 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.48 ' CD1' ' N ' ' A' ' 25' ' ' ARG . 0.4 OUTLIER -133.47 -32.66 1.14 Allowed 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 113.032 0.753 . . . . 0.0 113.032 -178.303 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.48 ' N ' ' CD1' ' A' ' 24' ' ' TYR . 1.6 ttm180 37.1 -117.55 0.15 Allowed 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 112.677 0.621 . . . . 0.0 112.677 -178.504 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -156.41 126.49 6.48 Favored 'General case' 0 C--N 1.344 0.332 0 C-N-CA 122.351 0.26 . . . . 0.0 110.574 -179.513 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 3.0 tmm? -104.92 159.33 15.89 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.606 0.241 . . . . 0.0 110.881 -179.688 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' TRP . . . . . 0.413 ' O ' ' HA2' ' A' ' 37' ' ' GLY . 3.2 t-105 -130.21 143.71 50.94 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.904 0.383 . . . . 0.0 111.286 179.84 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . 0.494 ' HB3' ' N ' ' A' ' 37' ' ' GLY . 0.0 OUTLIER 61.48 131.98 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.853 -179.9 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 3.7 t0 -178.76 -177.94 0.54 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.747 179.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . 64.28 -80.8 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.287 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -120.54 56.58 0.98 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.838 0.351 . . . . 0.0 111.033 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 46.4 t -127.04 83.63 2.19 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.909 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 37.2 p -48.59 -43.11 35.73 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-O 120.948 0.404 . . . . 0.0 110.697 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.445 ' O ' ' C ' ' A' ' 36' ' ' ARG . 0.3 OUTLIER -93.27 -151.01 0.29 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.921 179.335 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.453 ' HB3' ' CB ' ' A' ' 29' ' ' CYS . 0.3 OUTLIER 28.6 -139.97 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 122.593 0.357 . . . . 0.0 111.62 179.178 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.494 ' N ' ' HB3' ' A' ' 29' ' ' CYS . . . 65.35 9.23 41.83 Favored Glycine 0 C--N 1.338 0.66 0 C-N-CA 120.041 -1.076 . . . . 0.0 113.17 179.839 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.413 ' HB3' ' HB3' ' A' ' 69' ' ' PRO . 0.0 OUTLIER . . . . . 0 N--CA 1.463 0.204 0 CA-C-N 117.071 0.436 . . . . 0.0 110.991 179.736 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . 0.413 ' N ' ' HB2' ' A' ' 25' ' ' ARG . . . . . . . . 0 N--CA 1.449 -0.496 0 N-CA-C 111.387 -0.685 . . . . 0.0 111.387 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.735 ' H ' ' HA ' ' A' ' 23' ' ' CYS . 70.8 m 65.4 140.84 0.02 OUTLIER 'General case' 0 N--CA 1.461 0.115 0 CA-C-O 120.977 0.417 . . . . 0.0 111.685 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.479 ' HB1' ' CE1' ' A' ' 24' ' ' TYR . . . -117.19 -82.47 0.63 Allowed 'General case' 0 C--O 1.232 0.143 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.214 179.779 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 169.22 -39.37 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.897 0.38 . . . . 0.0 110.963 -179.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.7 m -162.71 -7.77 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 116.078 -0.51 . . . . 0.0 112.018 -179.417 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.512 ' N ' ' HD3' ' A' ' 49' ' ' PRO . 1.5 m 64.22 59.35 1.64 Allowed Pre-proline 0 C--N 1.332 -0.186 0 CA-C-O 120.539 0.209 . . . . 0.0 111.234 179.842 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.512 ' HD3' ' N ' ' A' ' 48' ' ' CYS . 2.9 Cg_endo -79.99 -2.02 11.8 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 122.675 2.25 . . . . 0.0 111.473 178.906 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 34.7 t -53.91 144.78 17.88 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.727 -0.669 . . . . 0.0 111.575 -179.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 7.5 pttt 179.99 75.22 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.767 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.413 ' HB2' ' HD2' ' A' ' 53' ' ' PRO . 0.6 OUTLIER -150.49 162.68 26.7 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.837 -179.864 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . 0.413 ' HD2' ' HB2' ' A' ' 52' ' ' LYS . 9.8 Cg_endo -50.81 -72.6 0.04 OUTLIER 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.741 2.294 . . . . 0.0 112.257 179.887 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.47 0.564 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.953 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.406 ' OG1' ' N ' ' A' ' 59' ' ' CYS . 0.0 OUTLIER . . . . . 0 CA--C 1.533 0.324 0 N-CA-C 110.562 -0.162 . . . . 0.0 110.562 . . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . 0.446 ' HA ' ' HB3' ' A' ' 24' ' ' TYR . 0.8 OUTLIER 167.45 172.41 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 120.778 0.323 . . . . 0.0 110.648 179.772 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . 0.514 ' HB2' ' O ' ' A' ' 23' ' ' CYS . 9.7 t -125.05 -86.49 0.63 Allowed 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.117 -179.603 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 19.6 p 53.59 -158.23 0.16 Allowed 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 120.603 0.24 . . . . 0.0 111.223 179.663 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER 46.83 -90.46 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.565 -179.966 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -127.03 -178.74 4.53 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.817 0.342 . . . . 0.0 111.099 -179.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.9 ptpp? -68.22 73.53 0.21 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.854 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 18.0 p -57.28 -31.0 65.16 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.263 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.459 ' HB3' ' CE1' ' A' ' 4' ' ' HIS . 1.5 m-80 -31.16 92.82 0.05 OUTLIER Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 115.656 -0.702 . . . . 0.0 112.477 -178.642 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -90.04 -170.93 0.44 Allowed 'Trans proline' 0 N--CA 1.457 -0.63 0 C-N-CA 123.029 2.486 . . . . 0.0 112.56 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.439 ' HB3' ' HD2' ' A' ' 69' ' ' PRO . 27.3 m80 -110.52 166.01 11.59 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.366 179.707 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . 0.439 ' HD2' ' HB3' ' A' ' 68' ' ' HIS . 83.0 Cg_exo -49.13 133.1 28.99 Favored 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 122.393 2.062 . . . . 0.0 112.013 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -46.73 -41.13 14.66 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.473 -179.463 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.682 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 192' ' ' CYS . . . . . 0.71 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.0 OUTLIER . . . . . 0 CA--C 1.499 -0.993 0 CA-C-O 121.927 0.87 . . . . 0.0 111.756 . . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 193' ' ' CYS . . . . . 0.71 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.0 OUTLIER 46.51 82.13 0.24 Allowed Pre-proline 0 N--CA 1.44 -0.952 0 CA-C-N 113.598 -1.637 . . . . 0.0 112.043 173.602 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 194' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -83.54 52.5 3.86 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.899 2.399 . . . . 0.0 112.644 -179.763 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -178.5 110.72 0.06 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.883 0.373 . . . . 0.0 111.4 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 196' ' ' THR . . . . . 0.589 ' C ' ' H ' ' B' ' 198' ' ' TYR . 4.9 t -152.75 41.9 0.2 Allowed Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.648 179.698 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 197' ' ' PRO . . . . . 0.519 ' CD ' ' N ' ' B' ' 196' ' ' THR . 74.4 Cg_endo -72.77 11.47 0.85 Allowed 'Trans proline' 0 C--N 1.348 0.526 0 C-N-CA 121.607 1.538 . . . . 0.0 108.951 176.277 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 198' ' ' TYR . . . . . 0.589 ' H ' ' C ' ' B' ' 196' ' ' THR . 0.9 OUTLIER . . . . . 0 C--O 1.248 1.019 0 CA-C-N 113.9 -1.5 . . . . 0.0 111.153 -179.088 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 4.5 mp . . . . . 0 N--CA 1.486 1.363 0 CA-C-O 120.704 0.288 . . . . 0.0 111.055 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . 0.458 HG11 ' N ' ' A' ' 3' ' ' CYS . 53.4 t 62.53 144.47 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.807 -179.925 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.458 ' N ' HG11 ' A' ' 2' ' ' VAL . 14.5 p -117.48 24.67 10.95 Favored 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 113.34 0.866 . . . . 0.0 113.34 -178.079 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' HIS . . . . . 0.414 ' CD2' ' HD2' ' A' ' 64' ' ' LYS . 0.0 OUTLIER 68.07 162.7 0.2 Allowed 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 118.185 0.448 . . . . 0.0 110.073 -179.757 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.3 p -78.82 -161.96 0.34 Allowed 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 110.361 -0.237 . . . . 0.0 110.361 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 16.9 p -74.98 53.7 0.62 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.769 0.319 . . . . 0.0 111.106 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 48.24 -148.15 0.22 Allowed 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 116.484 -0.326 . . . . 0.0 110.897 179.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.474 HG23 ' HD2' ' B' ' 194' ' ' PRO . 0.2 OUTLIER . . . . . 0 N--CA 1.461 0.099 0 CA-C-O 121.14 0.495 . . . . 0.0 111.324 179.585 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo . . . . . 0 C--O 1.231 0.152 0 N-CA-C 112.725 0.241 . . . . 0.0 112.725 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_exo -69.66 -52.81 0.31 Allowed 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.557 2.171 . . . . 0.0 111.399 179.376 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -112.82 -34.5 1.85 Allowed Glycine 0 N--CA 1.45 -0.377 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.999 179.54 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.12 -175.6 1.88 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.786 0.327 . . . . 0.0 110.792 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 21.3 m-20 -123.78 -0.4 8.54 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.647 -179.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.445 ' HB3' ' O ' ' A' ' 60' ' ' CYS . 0.1 OUTLIER -103.81 177.13 4.93 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.773 0.321 . . . . 0.0 110.917 -179.94 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.455 ' HA ' ' HA ' ' A' ' 44' ' ' CYS . 35.6 t -157.88 8.33 0.15 Allowed 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 -179.384 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.459 ' N ' ' HB2' ' A' ' 60' ' ' CYS . 3.2 m-85 52.18 173.09 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 120.643 0.258 . . . . 0.0 111.001 -179.723 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.454 ' HB2' ' O ' ' A' ' 24' ' ' TYR . 0.6 OUTLIER 161.35 104.28 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.907 179.675 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.0 -179.65 0.05 Allowed 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 178.932 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' MET . . . . . 0.474 ' O ' ' O ' ' A' ' 28' ' ' TRP . 0.0 OUTLIER -146.04 44.75 1.25 Allowed 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.114 -0.635 . . . . 0.0 112.405 -179.522 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' TRP . . . . . 0.595 ' HB2' ' HA2' ' A' ' 37' ' ' GLY . 14.3 p-90 45.65 172.3 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 113.482 0.919 . . . . 0.0 113.482 178.28 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER 37.1 -157.72 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 114.855 -1.066 . . . . 0.0 111.996 179.735 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 19.7 t0 -165.95 92.95 0.52 Allowed 'General case' 0 C--N 1.334 -0.096 0 CA-C-O 120.943 0.402 . . . . 0.0 111.206 -179.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . 62.79 140.13 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.709 179.578 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 17.6 t80 45.8 84.07 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 115.934 -0.576 . . . . 0.0 111.488 179.751 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 85.4 m -153.19 133.0 13.17 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.092 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -126.06 -44.21 1.77 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.752 179.888 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 1.2 m -93.13 -51.76 4.88 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.815 179.877 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 5.1 mpt_? -57.65 -170.15 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.728 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.595 ' HA2' ' HB2' ' A' ' 28' ' ' TRP . . . 105.07 -133.95 11.81 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.554 -0.831 . . . . 0.0 113.146 179.666 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.512 ' HD3' ' N ' ' A' ' 38' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.334 -0.085 0 CA-C-O 121.054 0.454 . . . . 0.0 110.914 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . 0.44 ' CA ' ' HB2' ' A' ' 24' ' ' TYR . . . . . . . . 0 CA--C 1.518 0.233 0 N-CA-C 112.827 -0.109 . . . . 0.0 112.827 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.455 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 0.9 OUTLIER 66.88 90.18 0.1 Allowed 'General case' 0 C--O 1.232 0.139 0 CA-C-O 121.034 0.445 . . . . 0.0 110.862 -179.783 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.417 ' HB2' ' CE1' ' A' ' 24' ' ' TYR . . . -128.08 -165.04 1.44 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.897 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -141.51 55.52 1.52 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.953 0.406 . . . . 0.0 110.977 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.503 ' OG1' ' HD3' ' A' ' 49' ' ' PRO . 4.0 t -175.12 137.66 0.41 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.631 -179.823 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.71 ' N ' ' HD3' ' A' ' 49' ' ' PRO . 56.5 m -118.54 30.43 0.15 Allowed Pre-proline 0 CA--C 1.537 0.479 0 N-CA-C 113.3 0.852 . . . . 0.0 113.3 -179.664 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.71 ' HD3' ' N ' ' A' ' 48' ' ' CYS . 36.3 Cg_exo -59.05 -16.57 33.59 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 121.703 1.602 . . . . 0.0 111.971 179.068 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 6.6 t -38.17 131.71 1.11 Allowed 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.78 -179.614 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 23.0 mtmm -166.59 -38.98 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.092 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.445 ' CB ' ' CD ' ' A' ' 53' ' ' PRO . 0.0 OUTLIER -117.81 -67.24 0.02 OUTLIER Pre-proline 0 CA--C 1.533 0.299 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.785 -179.416 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . 0.445 ' CD ' ' CB ' ' A' ' 52' ' ' LYS . 21.8 Cg_endo -60.45 -85.43 0.01 OUTLIER 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.137 1.891 . . . . 0.0 112.534 -179.43 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.47 0.536 0 CA-C-O 120.9 0.381 . . . . 0.0 110.673 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.23 0.072 0 CA-C-O 120.746 0.308 . . . . 0.0 110.693 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . 0.414 ' HA ' ' CE1' ' A' ' 24' ' ' TYR . 9.1 p -46.39 -30.17 2.01 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.361 -0.382 . . . . 0.0 111.064 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . 0.501 ' O ' ' CB ' ' A' ' 61' ' ' SER . 0.0 OUTLIER 74.16 172.7 0.28 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.748 179.939 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.501 ' CB ' ' O ' ' A' ' 60' ' ' CYS . 2.8 p 154.06 68.3 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.557 -179.814 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -161.78 173.44 14.61 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.041 -179.899 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -68.85 -42.2 77.43 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.811 179.901 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.414 ' HD2' ' CD2' ' A' ' 4' ' ' HIS . 40.5 mmtm -116.76 84.31 2.12 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.719 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -73.19 -27.09 61.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.178 -179.883 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -128.23 74.09 79.58 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.072 -179.883 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 15.3 Cg_exo -68.57 67.57 1.13 Allowed 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.803 2.335 . . . . 0.0 112.335 -179.817 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 2.5 m-70 61.7 153.94 0.11 Allowed Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.032 179.774 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -59.18 -162.22 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.675 2.25 . . . . 0.0 112.19 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.539 ' O ' ' C ' ' A' ' 71' ' ' GLN . 0.0 OUTLIER -121.91 -33.19 3.6 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.491 179.833 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.539 ' C ' ' O ' ' A' ' 70' ' ' LYS . 1.8 tt0 . . . . . 0 N--CA 1.473 0.72 0 N-CA-C 112.785 0.661 . . . . 0.0 112.785 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 192' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.502 -0.899 0 CA-C-O 122.23 1.014 . . . . 0.0 111.557 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 193' ' ' CYS . . . . . 0.583 ' N ' ' CD ' ' B' ' 194' ' ' PRO . 0.5 OUTLIER -144.12 35.29 0.19 Allowed Pre-proline 0 N--CA 1.43 -1.475 0 CA-C-N 113.025 -1.898 . . . . 0.0 112.826 -172.851 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 194' ' ' PRO . . . . . 0.583 ' CD ' ' N ' ' B' ' 193' ' ' CYS . 92.6 Cg_endo -79.89 -34.31 0.96 Allowed 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 122.312 2.008 . . . . 0.0 112.454 179.821 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -112.64 39.8 2.41 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.402 -179.531 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 196' ' ' THR . . . . . 0.725 ' N ' ' HD3' ' B' ' 197' ' ' PRO . 15.1 t -112.4 21.78 0.08 OUTLIER Pre-proline 0 CA--C 1.531 0.245 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 179.914 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 197' ' ' PRO . . . . . 0.725 ' HD3' ' N ' ' B' ' 196' ' ' THR . 8.0 Cg_exo -67.36 16.4 0.12 Allowed 'Trans proline' 0 C--N 1.357 1.025 0 CA-C-N 120.427 1.188 . . . . 0.0 109.593 176.304 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 198' ' ' TYR . . . . . 0.68 ' H ' ' C ' ' B' ' 196' ' ' THR . 38.4 t80 . . . . . 0 C--O 1.25 1.106 0 CA-C-N 114.554 -1.203 . . . . 0.0 111.23 -178.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 6.8 mm . . . . . 0 N--CA 1.487 1.381 0 CA-C-O 120.822 0.344 . . . . 0.0 111.009 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . 0.503 ' C ' ' HG3' ' A' ' 64' ' ' LYS . 95.8 t -129.35 138.44 54.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.565 179.602 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.488 ' N ' ' HG3' ' A' ' 64' ' ' LYS . 1.3 m -84.11 -174.56 5.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.507 -178.891 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' HIS . . . . . 0.453 ' CE1' ' HB2' ' A' ' 66' ' ' ASN . 0.0 OUTLIER -149.05 127.08 11.95 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.236 179.648 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -45.99 -50.19 15.18 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.151 -179.82 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 21.8 m 47.34 28.1 1.01 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.92 179.471 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.39 -70.1 0.19 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.057 0.456 . . . . 0.0 110.535 179.546 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 1.1 p . . . . . 0 C--N 1.328 -0.355 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.133 179.238 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo . . . . . 0 CA--C 1.531 0.337 0 N-CA-C 112.83 0.281 . . . . 0.0 112.83 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -59.16 -60.54 0.32 Allowed 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.841 2.36 . . . . 0.0 112.826 -179.596 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -58.84 -141.26 0.01 OUTLIER Glycine 0 CA--C 1.518 0.261 0 CA-C-N 116.004 -0.544 . . . . 0.0 113.116 -179.262 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -57.11 -163.74 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.751 0.31 . . . . 0.0 111.234 -179.672 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 4.8 m120 74.23 69.54 0.1 Allowed 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.764 -179.856 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.415 ' HG ' ' HA ' ' A' ' 61' ' ' SER . 3.4 mm? -86.41 178.85 6.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.961 -179.969 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.513 ' HA ' ' HA ' ' A' ' 44' ' ' CYS . 0.8 OUTLIER -55.01 171.44 0.14 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.098 0.475 . . . . 0.0 111.855 -179.266 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.504 ' CD1' ' HB2' ' A' ' 45' ' ' ALA . 0.0 OUTLIER -109.61 -162.55 0.81 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.731 -179.655 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -165.88 69.2 0.12 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.962 179.695 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.478 ' O ' ' HG3' ' A' ' 26' ' ' LYS . 11.6 tptm -95.39 62.44 2.44 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.814 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 6.4 ttt -97.09 90.59 5.21 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 10.7 t-105 -39.78 -86.5 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 -178.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 10.4 t 72.76 154.01 0.14 Allowed 'General case' 0 N--CA 1.462 0.172 0 CA-C-O 120.691 0.282 . . . . 0.0 110.513 -179.554 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -121.29 111.61 17.58 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.869 0.366 . . . . 0.0 111.367 -179.596 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . 57.15 -86.39 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.348 179.683 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 6.3 p90 -108.15 131.31 54.77 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.896 0.379 . . . . 0.0 110.805 -179.845 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -86.44 -166.23 1.49 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.904 -179.969 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 76.42 99.37 0.07 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.354 -179.551 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 4.7 p 60.83 32.12 20.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.539 -179.51 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 9.1 tpt85 -96.1 -84.99 0.34 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.214 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -123.4 -14.63 3.93 Favored Glycine 0 C--N 1.334 0.459 0 C-N-CA 120.388 -0.91 . . . . 0.0 113.56 -179.504 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.459 ' HA ' ' HG3' ' A' ' 70' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.331 -0.226 0 CA-C-N 117.188 0.494 . . . . 0.0 110.434 -179.621 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.672 0 CA-C-O 120.037 -0.313 . . . . 0.0 113.584 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.513 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 1.3 m 61.06 150.42 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 117.379 0.589 . . . . 0.0 111.222 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.504 ' HB2' ' CD1' ' A' ' 24' ' ' TYR . . . -135.2 -167.74 2.06 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.481 -179.445 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -114.78 -28.33 7.12 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.899 179.527 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.423 ' OG1' ' N ' ' A' ' 48' ' ' CYS . 1.8 t -158.09 -120.49 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.464 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.423 ' N ' ' OG1' ' A' ' 47' ' ' THR . 2.1 t -178.01 65.19 0.19 Allowed Pre-proline 0 C--O 1.231 0.119 0 CA-C-O 120.812 0.339 . . . . 0.0 111.103 -179.921 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -78.78 14.33 1.71 Allowed 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.575 2.184 . . . . 0.0 111.544 178.811 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.407 ' HB2' HG23 ' A' ' 58' ' ' THR . 31.5 t -61.0 135.71 57.87 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.584 -0.734 . . . . 0.0 111.415 -179.608 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 6.4 pttt 171.15 44.15 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.687 179.72 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.56 165.63 17.16 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.875 -179.87 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_exo -60.03 -68.08 0.05 OUTLIER 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 122.562 2.175 . . . . 0.0 112.339 -179.831 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.468 0.447 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.53 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.407 HG23 ' HB2' ' A' ' 50' ' ' SER . 71.9 p . . . . . 0 N--CA 1.468 0.447 0 N-CA-C 112.512 0.56 . . . . 0.0 112.512 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 2.6 p -51.96 -173.79 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.919 -179.509 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -163.56 70.08 0.22 Allowed 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.616 179.992 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.528 ' O ' ' CB ' ' A' ' 62' ' ' THR . 9.7 p -88.21 128.68 35.46 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.6 -179.492 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' THR . . . . . 0.528 ' CB ' ' O ' ' A' ' 61' ' ' SER . 6.0 t 144.41 -146.13 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 108.458 -0.942 . . . . 0.0 108.458 -179.758 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . 0.425 ' N ' ' OG1' ' A' ' 62' ' ' THR . 19.9 m-20 -74.38 55.39 0.62 Allowed 'General case' 0 C--N 1.332 -0.196 0 N-CA-C 109.684 -0.488 . . . . 0.0 109.684 178.581 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.503 ' HG3' ' C ' ' A' ' 2' ' ' VAL . 1.7 mmtp 36.05 45.46 0.31 Allowed 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 115.387 -0.824 . . . . 0.0 112.479 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . 0.435 ' HB2' ' HD3' ' A' ' 67' ' ' PRO . 0.0 OUTLIER 50.19 -82.63 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 115.481 -0.781 . . . . 0.0 112.301 178.651 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.465 ' N ' ' HD3' ' A' ' 67' ' ' PRO . 1.0 OUTLIER 52.98 57.61 14.56 Favored Pre-proline 0 CA--C 1.532 0.283 0 CA-C-O 120.752 0.311 . . . . 0.0 111.178 -179.589 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . 0.465 ' HD3' ' N ' ' A' ' 66' ' ' ASN . 63.8 Cg_endo -92.38 18.3 1.11 Allowed 'Trans proline' 0 N--CA 1.458 -0.616 0 C-N-CA 122.98 2.453 . . . . 0.0 113.142 -179.552 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.408 ' HB3' ' HD2' ' A' ' 69' ' ' PRO . 79.7 m80 60.83 158.63 0.11 Allowed Pre-proline 0 C--N 1.33 -0.243 0 CA-C-N 116.698 -0.228 . . . . 0.0 110.65 -179.793 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . 0.446 ' O ' ' N ' ' A' ' 71' ' ' GLN . 58.8 Cg_endo -71.82 64.12 3.18 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.424 2.082 . . . . 0.0 112.506 -179.706 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.459 ' HG3' ' HA ' ' A' ' 38' ' ' LYS . 2.4 mmmm 50.67 -87.66 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.174 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.446 ' N ' ' O ' ' A' ' 69' ' ' PRO . 8.2 tp-100 . . . . . 0 CA--C 1.529 0.173 0 CA-C-N 116.641 -0.254 . . . . 0.0 111.682 179.409 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 192' ' ' CYS . . . . . 0.701 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.5 OUTLIER . . . . . 0 CA--C 1.497 -1.059 0 CA-C-O 122.045 0.926 . . . . 0.0 111.473 . . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 193' ' ' CYS . . . . . 0.701 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.0 OUTLIER -155.3 166.7 15.64 Favored Pre-proline 0 N--CA 1.435 -1.203 0 CA-C-N 113.44 -1.709 . . . . 0.0 111.574 -173.647 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 194' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -74.23 -162.41 0.14 Allowed 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.613 2.208 . . . . 0.0 112.365 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -133.64 58.52 1.77 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.249 179.622 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 196' ' ' THR . . . . . 0.738 ' C ' ' H ' ' B' ' 198' ' ' TYR . 16.0 p -101.82 12.13 0.06 OUTLIER Pre-proline 0 CA--C 1.534 0.347 0 N-CA-C 113.893 1.072 . . . . 0.0 113.893 -179.508 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 197' ' ' PRO . . . . . 0.695 ' HD3' ' N ' ' B' ' 196' ' ' THR . 13.5 Cg_exo -66.47 22.78 0.1 OUTLIER 'Trans proline' 0 C--N 1.359 1.116 0 CA-C-N 121.014 1.398 . . . . 0.0 109.934 176.85 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 198' ' ' TYR . . . . . 0.738 ' H ' ' C ' ' B' ' 196' ' ' THR . 35.4 t80 . . . . . 0 C--O 1.248 1.011 0 CA-C-N 114.584 -1.189 . . . . 0.0 111.281 -178.797 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 1' ' ' ILE . . . . . 0.409 ' CG1' ' HA ' ' A' ' 63' ' ' ASP . 1.0 OUTLIER . . . . . 0 N--CA 1.487 1.38 0 CA-C-O 120.396 0.141 . . . . 0.0 110.924 . . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . 0.4 ' CG1' ' N ' ' A' ' 3' ' ' CYS . 84.1 t -42.49 159.7 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.462 0.171 0 CA-C-O 120.528 0.204 . . . . 0.0 111.29 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.4 ' N ' ' CG1' ' A' ' 2' ' ' VAL . 49.7 t -158.06 41.89 0.28 Allowed 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 112.582 0.586 . . . . 0.0 112.582 -178.716 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' HIS . . . . . 0.417 ' CE1' ' HB2' ' A' ' 64' ' ' LYS . 0.1 OUTLIER 49.95 -176.91 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.82 0.343 . . . . 0.0 111.687 179.105 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 17.1 p -63.55 -132.05 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.7 179.782 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 6.4 p -96.15 30.84 2.33 Favored 'General case' 0 CA--C 1.528 0.121 0 CA-C-O 120.812 0.339 . . . . 0.0 111.106 -179.857 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 60.93 52.75 4.02 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.911 0.386 . . . . 0.0 111.098 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 25.5 p . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.721 179.913 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.459 ' HB2' ' HD3' ' A' ' 18' ' ' PRO . 37.1 Cg_exo . . . . . 0 CA--C 1.53 0.282 0 CA-C-O 120.481 0.117 . . . . 0.0 112.378 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.459 ' HD3' ' HB2' ' A' ' 17' ' ' PRO . 77.2 Cg_endo -87.16 174.22 5.39 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 122.742 2.295 . . . . 0.0 112.471 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 52.98 -167.06 1.19 Allowed Glycine 0 C--N 1.331 0.276 0 C-N-CA 120.913 -0.66 . . . . 0.0 112.855 179.795 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.48 ' HB2' ' CB ' ' A' ' 46' ' ' ALA . 0.3 OUTLIER -100.21 -153.81 0.46 Allowed 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 110.449 -0.204 . . . . 0.0 110.449 179.813 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 28.9 p-10 -106.19 64.8 0.68 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.748 0.308 . . . . 0.0 111.541 -179.574 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.464 ' O ' ' N ' ' A' ' 24' ' ' TYR . 4.1 mm? -112.89 7.57 18.35 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.295 179.541 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.697 ' HB3' ' HB3' ' A' ' 60' ' ' CYS . 40.0 t 24.19 43.69 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.477 0.711 . . . . 0.0 112.623 179.867 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.58 ' HB3' ' HA3' ' A' ' 43' ' ' GLY . 0.0 OUTLIER -36.32 91.52 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.87 178.733 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.465 ' N ' ' O ' ' A' ' 23' ' ' CYS . 2.0 ptt180 -97.18 98.62 10.18 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.883 0.373 . . . . 0.0 111.28 -179.242 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.53 177.4 2.45 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.088 -0.505 . . . . 0.0 109.713 179.195 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 18.1 ttp -176.77 164.47 2.41 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.806 0.336 . . . . 0.0 110.703 179.812 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 2.4 t90 -105.74 -137.15 0.36 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.279 179.828 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 71.15 -162.73 0.14 Allowed 'General case' 0 CA--C 1.529 0.165 0 CA-C-O 120.682 0.277 . . . . 0.0 110.558 -179.912 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 173.72 37.36 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.96 179.875 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . 76.29 -54.52 0.6 Allowed 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.498 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -46.24 -28.71 1.35 Allowed 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 111.815 0.302 . . . . 0.0 111.815 -179.591 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -83.84 133.81 34.73 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.87 0.367 . . . . 0.0 110.62 179.784 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 74.2 p -64.42 76.93 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.313 -179.638 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 29.6 t 49.15 59.9 4.13 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.287 179.695 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 4.9 mmm-85 -101.98 -107.53 0.24 Allowed 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.686 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.458 ' O ' ' HG2' ' A' ' 38' ' ' LYS . . . 76.22 -95.38 1.06 Allowed Glycine 0 C--N 1.335 0.482 0 C-N-CA 120.607 -0.806 . . . . 0.0 113.115 179.745 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.458 ' HG2' ' O ' ' A' ' 37' ' ' GLY . 0.0 OUTLIER . . . . . 0 N--CA 1.468 0.428 0 N-CA-C 112.615 0.598 . . . . 0.0 112.615 -179.574 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . 0.58 ' HA3' ' HB3' ' A' ' 24' ' ' TYR . . . . . . . . 0 N--CA 1.449 -0.456 0 CA-C-O 120.465 -0.075 . . . . 0.0 113.259 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.456 ' N ' ' HB2' ' A' ' 24' ' ' TYR . 0.5 OUTLIER 55.44 79.34 0.16 Allowed 'General case' 0 CA--C 1.531 0.221 0 CA-C-O 120.764 0.316 . . . . 0.0 110.684 -179.29 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -96.52 -160.7 0.81 Allowed 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.492 -179.51 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.48 ' CB ' ' HB2' ' A' ' 20' ' ' GLU . . . -167.28 50.41 0.06 Allowed 'General case' 0 C--N 1.333 -0.115 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.452 -179.705 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.542 ' CG2' ' HD3' ' A' ' 49' ' ' PRO . 0.0 OUTLIER 178.41 -33.2 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.137 179.871 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.576 ' N ' ' HD3' ' A' ' 49' ' ' PRO . 85.5 m 68.66 34.32 0.1 Allowed Pre-proline 0 CA--C 1.534 0.341 0 N-CA-C 113.519 0.933 . . . . 0.0 113.519 179.135 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.576 ' HD3' ' N ' ' A' ' 48' ' ' CYS . 44.1 Cg_endo -88.88 13.97 2.37 Favored 'Trans proline' 0 C--N 1.35 0.608 0 C-N-CA 122.08 1.853 . . . . 0.0 110.894 178.106 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.495 ' O ' ' HB2' ' A' ' 51' ' ' LYS . 0.3 OUTLIER -97.05 42.33 1.09 Allowed 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 115.247 -0.888 . . . . 0.0 111.547 -178.726 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.495 ' HB2' ' O ' ' A' ' 50' ' ' SER . 12.5 mttt 74.56 162.53 0.26 Allowed 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.667 -179.638 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.561 ' HB2' ' CD ' ' A' ' 53' ' ' PRO . 0.1 OUTLIER -128.72 -70.51 0.02 OUTLIER Pre-proline 0 CA--C 1.534 0.363 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.891 -179.602 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . 0.561 ' CD ' ' HB2' ' A' ' 52' ' ' LYS . 36.8 Cg_endo -66.67 -61.94 0.08 OUTLIER 'Trans proline' 0 C--N 1.352 0.715 0 C-N-CA 121.987 1.791 . . . . 0.0 112.9 -179.641 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . 0.426 ' CE1' ' HG2' ' A' ' 53' ' ' PRO . 0.0 OUTLIER . . . . . 0 N--CA 1.471 0.597 0 CA-C-O 120.916 0.389 . . . . 0.0 111.649 -179.573 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 45.1 p . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.763 0.316 . . . . 0.0 111.045 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . 0.451 ' HA ' ' CD1' ' A' ' 24' ' ' TYR . 2.5 m 50.78 -177.3 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.814 -179.759 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . 0.697 ' HB3' ' HB3' ' A' ' 23' ' ' CYS . 2.2 t -141.19 -94.81 0.14 Allowed 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 116.635 -0.257 . . . . 0.0 110.862 -179.858 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.43 ' HB2' ' HA ' ' A' ' 22' ' ' LEU . 1.6 t 54.25 172.75 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.164 0 CA-C-O 120.892 0.377 . . . . 0.0 111.56 179.394 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' THR . . . . . 0.402 ' N ' ' OG ' ' A' ' 61' ' ' SER . 1.2 m 74.64 79.07 0.11 Allowed 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.243 179.679 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . 0.409 ' HA ' ' CG1' ' A' ' 1' ' ' ILE . 11.5 m-20 52.36 -178.39 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.972 179.881 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.417 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 0.0 OUTLIER -57.35 88.79 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.683 179.851 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 3.2 p -92.13 42.56 1.11 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.466 -179.825 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.417 ' O ' ' CD2' ' A' ' 68' ' ' HIS . 2.3 m-20 -106.67 87.46 2.81 Favored Pre-proline 0 C--N 1.326 -0.433 0 C-N-CA 120.897 -0.321 . . . . 0.0 110.651 179.582 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -73.03 -4.6 15.71 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.727 2.285 . . . . 0.0 113.069 -179.64 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.438 ' CB ' ' CD ' ' A' ' 69' ' ' PRO . 0.3 OUTLIER 64.29 178.56 0.05 OUTLIER Pre-proline 0 C--N 1.331 -0.221 0 N-CA-C 110.396 -0.224 . . . . 0.0 110.396 -179.763 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . 0.438 ' CD ' ' CB ' ' A' ' 68' ' ' HIS . 77.7 Cg_exo -50.24 123.22 10.67 Favored 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.377 2.051 . . . . 0.0 112.479 -179.84 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.28 29.97 2.99 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.919 179.868 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 1.5 pp0? . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.068 -179.857 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 192' ' ' CYS . . . . . 0.714 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.0 OUTLIER . . . . . 0 CA--C 1.498 -1.043 0 CA-C-O 122.284 1.04 . . . . 0.0 112.038 . . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 193' ' ' CYS . . . . . 0.714 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.0 OUTLIER 44.72 49.79 6.35 Favored Pre-proline 0 N--CA 1.435 -1.201 0 CA-C-N 113.073 -1.876 . . . . 0.0 112.412 174.05 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 194' ' ' PRO . . . . . 0.487 ' HD3' ' N ' ' B' ' 193' ' ' CYS . 64.0 Cg_endo -87.24 -25.21 1.09 Allowed 'Trans proline' 0 N--CA 1.459 -0.531 0 C-N-CA 122.596 2.197 . . . . 0.0 112.362 179.671 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -94.69 -173.86 3.13 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.265 -179.611 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 196' ' ' THR . . . . . 0.633 ' N ' ' HD3' ' B' ' 197' ' ' PRO . 0.2 OUTLIER -160.36 48.78 0.26 Allowed Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.634 -179.915 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 197' ' ' PRO . . . . . 0.633 ' HD3' ' N ' ' B' ' 196' ' ' THR . 6.0 Cg_exo -74.93 16.75 0.63 Allowed 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 121.879 1.719 . . . . 0.0 108.768 176.182 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 198' ' ' TYR . . . . . 0.614 ' H ' ' C ' ' B' ' 196' ' ' THR . 11.9 t80 . . . . . 0 C--O 1.25 1.08 0 CA-C-N 113.771 -1.559 . . . . 0.0 111.326 -178.659 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.382 0 CA-C-O 120.816 0.341 . . . . 0.0 111.01 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 60.9 t 63.4 159.19 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.826 -179.653 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.499 ' HB3' ' HB2' ' A' ' 64' ' ' LYS . 38.6 m -96.05 177.4 5.75 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.666 -179.657 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' HIS . . . . . 0.491 ' NE2' ' O ' ' A' ' 63' ' ' ASP . 0.0 OUTLIER -135.62 160.97 36.85 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.652 -0.249 . . . . 0.0 110.594 179.835 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.452 ' C ' ' O ' ' A' ' 4' ' ' HIS . 20.5 p -21.96 134.43 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 113.373 0.879 . . . . 0.0 113.373 -179.753 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 3.7 t -101.02 -15.13 17.56 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.266 178.852 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.442 ' CB ' ' HG3' ' B' ' 194' ' ' PRO . . . -63.85 -161.73 0.01 OUTLIER 'General case' 0 C--O 1.232 0.142 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.905 179.718 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.446 ' HB ' ' HD3' ' B' ' 194' ' ' PRO . 2.8 t . . . . . 0 CA--C 1.531 0.234 0 CA-C-N 116.81 -0.177 . . . . 0.0 111.3 179.787 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo . . . . . 0 N--CA 1.46 -0.449 0 N-CA-C 112.716 0.237 . . . . 0.0 112.716 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -78.0 -63.34 0.03 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.572 0 C-N-CA 122.263 1.976 . . . . 0.0 111.709 179.375 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -134.3 17.01 4.33 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.96 -0.638 . . . . 0.0 112.191 179.32 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.425 ' O ' ' CG ' ' A' ' 21' ' ' ASN . 0.0 OUTLIER 173.17 -165.88 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.702 0.287 . . . . 0.0 110.729 -179.895 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . 0.479 ' HA ' ' HA ' ' A' ' 46' ' ' ALA . 1.4 p30 67.18 3.93 3.42 Favored 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 112.718 0.636 . . . . 0.0 112.718 179.576 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.42 ' HB3' ' N ' ' A' ' 61' ' ' SER . 0.8 OUTLIER 39.04 -161.89 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 178.881 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -121.28 -11.41 8.8 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.008 -179.935 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.574 ' HB2' ' H ' ' A' ' 44' ' ' CYS . 0.9 OUTLIER 46.54 -174.83 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 120.785 0.326 . . . . 0.0 111.229 -179.738 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.428 ' CD ' ' HG3' ' A' ' 67' ' ' PRO . 14.3 ttt-85 172.56 94.77 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.892 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.411 ' CG ' ' N ' ' A' ' 27' ' ' MET . 0.3 OUTLIER -62.11 163.97 7.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.276 179.483 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' MET . . . . . 0.411 ' N ' ' CG ' ' A' ' 26' ' ' LYS . 66.0 ttp -153.71 163.27 40.29 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.607 179.685 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' TRP . . . . . 0.415 ' CE3' ' HB3' ' A' ' 30' ' ' ASP . 0.0 OUTLIER -114.98 -74.15 0.62 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.06 179.963 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 1.5 m 60.32 52.0 5.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.913 0.387 . . . . 0.0 110.715 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.415 ' HB3' ' CE3' ' A' ' 28' ' ' TRP . 3.6 p30 -87.41 157.5 19.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.097 -179.85 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . 57.16 52.44 8.99 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.162 179.712 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER 56.26 97.43 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.795 179.962 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.42 ' O ' ' N ' ' A' ' 35' ' ' SER . 0.3 OUTLIER -56.56 -73.72 0.06 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.058 -179.827 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 16.3 t 55.08 -85.89 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.014 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.42 ' N ' ' O ' ' A' ' 33' ' ' CYS . 56.7 p -101.09 23.82 10.26 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.867 0.365 . . . . 0.0 110.769 179.663 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.41 ' CA ' ' HE3' ' A' ' 70' ' ' LYS . 0.2 OUTLIER -119.7 -163.07 0.96 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.499 179.987 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 122.01 11.38 5.83 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.545 -0.836 . . . . 0.0 112.85 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.245 0 CA-C-O 121.037 0.446 . . . . 0.0 110.762 179.797 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . 0.457 ' HA3' ' CB ' ' A' ' 24' ' ' TYR . . . . . . . . 0 N--CA 1.45 -0.405 0 CA-C-O 120.289 -0.173 . . . . 0.0 113.184 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.574 ' H ' ' HB2' ' A' ' 24' ' ' TYR . 24.3 t 51.86 86.94 0.03 OUTLIER 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 117.081 0.44 . . . . 0.0 110.166 -179.539 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.407 ' O ' ' HA ' ' A' ' 21' ' ' ASN . . . -153.56 155.91 37.04 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.966 0.412 . . . . 0.0 111.989 -178.97 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.479 ' HA ' ' HA ' ' A' ' 21' ' ' ASN . . . -85.66 80.13 9.11 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.436 179.941 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.45 ' OG1' ' N ' ' A' ' 48' ' ' CYS . 0.6 OUTLIER -170.58 -179.61 2.99 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.649 179.831 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.676 ' O ' ' N ' ' A' ' 50' ' ' SER . 0.5 OUTLIER 179.02 -48.24 0.0 OUTLIER Pre-proline 0 C--N 1.333 -0.148 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.568 179.934 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.426 ' CD ' ' N ' ' A' ' 48' ' ' CYS . 53.8 Cg_exo -52.28 72.56 0.02 OUTLIER 'Trans proline' 0 C--N 1.351 0.694 0 C-N-CA 122.083 1.855 . . . . 0.0 111.067 179.685 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.676 ' N ' ' O ' ' A' ' 48' ' ' CYS . 28.7 t -118.63 -80.01 0.61 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.378 -0.828 . . . . 0.0 111.258 -178.342 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 10.2 mtmm 58.91 34.21 23.51 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.836 0.351 . . . . 0.0 111.043 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.41 162.44 33.69 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.809 179.925 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -60.32 -67.84 0.05 OUTLIER 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.494 2.129 . . . . 0.0 112.117 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.468 0.428 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.134 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.143 0 CA-C-O 120.868 0.366 . . . . 0.0 111.35 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . 0.479 ' HA ' ' CD1' ' A' ' 24' ' ' TYR . 1.2 m -50.97 138.76 18.67 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.939 179.67 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . 0.611 ' SG ' ' N ' ' A' ' 65' ' ' CYS . 48.5 t -112.07 -83.91 0.58 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.708 -179.593 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.465 ' O ' ' N ' ' A' ' 63' ' ' ASP . 47.0 t 65.65 -148.32 0.22 Allowed 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.138 -179.32 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' THR . . . . . 0.417 ' CG2' ' C ' ' A' ' 61' ' ' SER . 0.2 OUTLIER 49.09 -86.82 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 122.147 0.179 . . . . 0.0 111.22 -179.806 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . 0.491 ' O ' ' NE2' ' A' ' 4' ' ' HIS . 1.6 p30 -153.64 79.03 1.15 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.666 0.269 . . . . 0.0 111.659 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.499 ' HB2' ' HB3' ' A' ' 3' ' ' CYS . 0.0 OUTLIER 41.19 23.61 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.788 0.662 . . . . 0.0 112.788 179.365 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . 0.611 ' N ' ' SG ' ' A' ' 60' ' ' CYS . 0.5 OUTLIER 69.82 -42.39 0.51 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.722 0.296 . . . . 0.0 111.016 179.998 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.607 ' N ' ' HD3' ' A' ' 67' ' ' PRO . 0.9 OUTLIER 57.37 53.33 6.29 Favored Pre-proline 0 C--O 1.232 0.179 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.677 -179.659 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . 0.607 ' HD3' ' N ' ' A' ' 66' ' ' ASN . 19.5 Cg_endo -92.29 -66.36 0.01 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.945 0 C-N-CA 123.075 2.517 . . . . 0.0 111.521 179.148 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.573 ' HB3' ' HD2' ' A' ' 69' ' ' PRO . 82.5 m-70 58.21 166.24 0.07 OUTLIER Pre-proline 0 C--N 1.331 -0.197 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.087 179.148 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . 0.573 ' HD2' ' HB3' ' A' ' 68' ' ' HIS . 28.2 Cg_exo -35.15 123.72 0.21 Allowed 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 123.1 2.533 . . . . 0.0 113.145 -179.798 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.416 ' HD3' ' N ' ' A' ' 71' ' ' GLN . 0.0 OUTLIER -98.08 -7.18 30.2 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.236 -179.964 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.416 ' N ' ' HD3' ' A' ' 70' ' ' LYS . 2.1 tt0 . . . . . 0 C--N 1.332 -0.187 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.424 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 192' ' ' CYS . . . . . 0.706 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.5 OUTLIER . . . . . 0 CA--C 1.497 -1.077 0 CA-C-O 121.798 0.809 . . . . 0.0 112.007 . . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 193' ' ' CYS . . . . . 0.706 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.0 OUTLIER -153.98 103.17 2.46 Favored Pre-proline 0 N--CA 1.436 -1.15 0 CA-C-N 113.734 -1.576 . . . . 0.0 111.964 -173.444 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 194' ' ' PRO . . . . . 0.446 ' HD3' ' HB ' ' A' ' 8' ' ' THR . 38.3 Cg_endo -81.74 -66.7 0.02 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.768 0 C-N-CA 122.395 2.063 . . . . 0.0 111.979 179.486 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -172.63 14.88 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 113.294 0.85 . . . . 0.0 113.294 179.819 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 196' ' ' THR . . . . . 0.595 ' C ' ' H ' ' B' ' 198' ' ' TYR . 1.4 t -147.2 36.85 0.17 Allowed Pre-proline 0 C--N 1.334 -0.094 0 C-N-CA 120.389 -0.524 . . . . 0.0 112.024 179.725 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 197' ' ' PRO . . . . . 0.577 ' CD ' ' N ' ' B' ' 196' ' ' THR . 72.1 Cg_endo -72.2 13.7 0.51 Allowed 'Trans proline' 0 C--N 1.35 0.612 0 C-N-CA 121.518 1.478 . . . . 0.0 109.359 176.113 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 198' ' ' TYR . . . . . 0.595 ' H ' ' C ' ' B' ' 196' ' ' THR . 1.1 t80 . . . . . 0 C--O 1.248 0.976 0 CA-C-N 114.12 -1.4 . . . . 0.0 111.289 -178.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 1' ' ' ILE . . . . . 0.495 ' O ' ' HB ' ' A' ' 2' ' ' VAL . 0.1 OUTLIER . . . . . 0 N--CA 1.485 1.309 0 CA-C-O 120.466 0.174 . . . . 0.0 110.812 . . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . 0.495 ' HB ' ' O ' ' A' ' 1' ' ' ILE . 4.0 p 147.44 138.08 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 C-N-CA 123.461 0.705 . . . . 0.0 110.439 179.388 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.487 ' O ' ' C ' ' A' ' 4' ' ' HIS . 0.5 OUTLIER -160.08 54.01 0.34 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.68 -179.719 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' HIS . . . . . 0.487 ' C ' ' O ' ' A' ' 3' ' ' CYS . 4.9 p-80 -23.7 110.31 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 122.659 0.384 . . . . 0.0 112.033 179.627 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.6 t -44.82 149.86 0.4 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.07 -0.513 . . . . 0.0 111.319 -179.642 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 16.8 p -81.01 2.34 27.41 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.448 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -58.19 88.69 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.727 0.299 . . . . 0.0 111.205 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 1.2 p . . . . . 0 C--N 1.33 -0.262 0 CA-C-O 121.049 0.452 . . . . 0.0 111.206 179.55 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.518 ' CB ' ' HD3' ' A' ' 18' ' ' PRO . 10.5 Cg_exo . . . . . 0 CA--C 1.531 0.352 0 N-CA-C 112.98 0.339 . . . . 0.0 112.98 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.518 ' HD3' ' CB ' ' A' ' 17' ' ' PRO . 43.4 Cg_endo -97.16 -166.5 0.1 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.77 0 C-N-CA 122.818 2.345 . . . . 0.0 112.795 -179.4 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 78.33 -65.4 3.37 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.801 179.48 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -113.32 156.42 23.4 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.978 0.418 . . . . 0.0 111.207 -179.577 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . 0.434 ' O ' ' CD1' ' A' ' 22' ' ' LEU . 0.2 OUTLIER -103.3 40.21 1.44 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.62 179.871 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.434 ' CD1' ' O ' ' A' ' 21' ' ' ASN . 0.6 OUTLIER 165.82 -172.99 0.02 OUTLIER 'General case' 0 N--CA 1.461 0.121 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.033 -179.692 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.541 ' HB2' ' C ' ' A' ' 60' ' ' CYS . 1.6 m -120.32 88.55 2.96 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.429 0.633 . . . . 0.0 111.292 -179.835 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.507 ' O ' ' N ' ' A' ' 44' ' ' CYS . 14.7 t80 -78.51 125.38 29.29 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.063 -0.971 . . . . 0.0 112.201 -179.254 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -155.97 137.72 14.29 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.651 -0.25 . . . . 0.0 110.653 179.263 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 4.5 mttt -80.04 145.25 32.58 Favored 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 120.901 -0.32 . . . . 0.0 110.922 -179.831 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 50.1 tpp -153.49 146.05 24.14 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.332 -179.783 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' TRP . . . . . 0.445 ' O ' ' CB ' ' A' ' 29' ' ' CYS . 0.3 OUTLIER -149.04 -160.54 1.19 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.768 179.88 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . 0.631 ' HA ' ' HB3' ' A' ' 33' ' ' CYS . 0.1 OUTLIER 85.68 -17.6 0.4 Allowed 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 122.806 0.442 . . . . 0.0 111.724 -179.921 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 41.1 m-20 -54.19 126.73 24.05 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.776 0.322 . . . . 0.0 110.978 -179.91 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . 67.28 -72.29 0.09 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.878 -179.793 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . 0.452 ' O ' ' SG ' ' A' ' 33' ' ' CYS . 18.6 m-85 -71.63 -164.24 0.12 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.34 179.647 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.631 ' HB3' ' HA ' ' A' ' 29' ' ' CYS . 0.5 OUTLIER 74.51 -50.12 0.67 Allowed 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 112.094 0.405 . . . . 0.0 112.094 179.554 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.402 ' N ' ' SG ' ' A' ' 33' ' ' CYS . 0.3 OUTLIER 53.73 55.6 8.28 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.871 0.367 . . . . 0.0 110.685 -179.854 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 67.28 35.2 4.5 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.14 -179.811 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -144.71 12.8 1.49 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.866 -179.909 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.431 ' N ' ' HB2' ' A' ' 33' ' ' CYS . . . -87.7 -52.39 3.0 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.647 -0.787 . . . . 0.0 112.862 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.468 0.435 0 CA-C-O 120.839 0.352 . . . . 0.0 111.111 -179.677 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.554 0 N-CA-C 110.165 -1.174 . . . . 0.0 110.165 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.507 ' N ' ' O ' ' A' ' 24' ' ' TYR . 0.1 OUTLIER 76.57 109.29 0.08 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.041 0.448 . . . . 0.0 110.49 -178.155 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.551 ' O ' ' N ' ' A' ' 47' ' ' THR . . . -173.5 147.11 1.42 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.137 -179.668 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.474 ' O ' ' CB ' ' A' ' 47' ' ' THR . . . 47.33 -82.43 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.709 179.394 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.551 ' N ' ' O ' ' A' ' 45' ' ' ALA . 1.2 t 156.76 62.19 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.402 179.821 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.497 ' N ' ' HD3' ' A' ' 49' ' ' PRO . 49.6 t 43.91 53.51 10.41 Favored Pre-proline 0 N--CA 1.466 0.375 0 N-CA-C 111.787 0.292 . . . . 0.0 111.787 179.688 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.497 ' HD3' ' N ' ' A' ' 48' ' ' CYS . 37.4 Cg_exo -55.0 -25.45 44.6 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 121.984 1.789 . . . . 0.0 111.002 179.088 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 3.0 t -55.78 179.95 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.206 -0.906 . . . . 0.0 111.323 179.751 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 11.8 ptpt 175.89 -47.72 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.035 179.881 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.419 ' HB2' ' CE2' ' A' ' 54' ' ' TYR . 0.0 OUTLIER -75.02 149.27 85.08 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.974 -179.898 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -59.32 -47.66 16.34 Favored 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.59 2.194 . . . . 0.0 112.364 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . 0.419 ' CE2' ' HB2' ' A' ' 52' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.471 0.593 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.996 -179.751 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 8.9 t . . . . . 0 C--O 1.232 0.167 0 CA-C-O 120.72 0.295 . . . . 0.0 110.425 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . 0.41 ' HB3' HD23 ' A' ' 22' ' ' LEU . 0.0 OUTLIER -101.29 134.78 43.82 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.872 0.367 . . . . 0.0 110.292 179.681 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . 0.541 ' C ' ' HB2' ' A' ' 23' ' ' CYS . 0.5 OUTLIER -123.45 15.68 9.65 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.448 -179.418 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.526 ' N ' ' HB2' ' A' ' 23' ' ' CYS . 0.3 OUTLIER -64.94 95.16 0.15 Allowed 'General case' 0 C--N 1.333 -0.116 0 CA-C-O 121.057 0.456 . . . . 0.0 111.289 -179.123 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER 168.39 67.81 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.377 179.826 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . 0.404 ' HA ' ' CG1' ' A' ' 2' ' ' VAL . 1.2 t0 64.81 -163.91 0.25 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.551 -179.737 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.402 ' HB3' ' CE1' ' A' ' 4' ' ' HIS . 0.0 OUTLIER -60.74 87.59 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.88 0.371 . . . . 0.0 110.306 179.864 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 16.7 t -94.95 -50.01 5.3 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.941 -179.735 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 29.4 m-20 -43.29 100.47 0.23 Allowed Pre-proline 0 N--CA 1.463 0.201 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.533 -179.761 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -90.89 131.57 1.53 Allowed 'Trans proline' 0 N--CA 1.454 -0.797 0 C-N-CA 122.732 2.288 . . . . 0.0 112.059 -180.0 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 5.7 p80 -48.0 161.49 0.36 Allowed Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.726 179.83 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -47.21 173.07 0.03 OUTLIER 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.429 2.086 . . . . 0.0 112.083 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.436 ' O ' ' C ' ' A' ' 71' ' ' GLN . 0.0 OUTLIER -54.47 -27.35 36.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.034 -179.817 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.436 ' C ' ' O ' ' A' ' 70' ' ' LYS . 22.8 tp60 . . . . . 0 N--CA 1.469 0.487 0 O-C-N 123.571 0.544 . . . . 0.0 112.388 179.78 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 192' ' ' CYS . . . . . 0.704 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.0 OUTLIER . . . . . 0 CA--C 1.498 -1.036 0 CA-C-O 121.959 0.885 . . . . 0.0 111.467 . . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 193' ' ' CYS . . . . . 0.704 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.1 OUTLIER 44.67 178.26 0.0 OUTLIER Pre-proline 0 C--N 1.314 -0.972 0 CA-C-N 113.048 -1.887 . . . . 0.0 112.954 173.622 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 194' ' ' PRO . . . . . 0.401 ' HD2' ' HB2' ' B' ' 193' ' ' CYS . 95.2 Cg_endo -86.75 -178.62 2.68 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.815 2.343 . . . . 0.0 112.706 -179.469 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -116.09 -69.48 0.85 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.296 -179.858 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 196' ' ' THR . . . . . 0.612 ' C ' ' H ' ' B' ' 198' ' ' TYR . 12.8 t -143.05 40.79 0.34 Allowed Pre-proline 0 C--N 1.33 -0.256 0 N-CA-C 112.376 0.509 . . . . 0.0 112.376 -179.449 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 197' ' ' PRO . . . . . 0.526 ' CD ' ' N ' ' B' ' 196' ' ' THR . 73.8 Cg_endo -74.38 17.79 0.51 Allowed 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 121.52 1.48 . . . . 0.0 108.987 175.953 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 198' ' ' TYR . . . . . 0.612 ' H ' ' C ' ' B' ' 196' ' ' THR . 77.9 t80 . . . . . 0 C--O 1.249 1.079 0 CA-C-N 113.994 -1.457 . . . . 0.0 111.272 -178.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 1' ' ' ILE . . . . . 0.416 ' CG2' ' HA ' ' A' ' 62' ' ' THR . 27.2 mm . . . . . 0 N--CA 1.487 1.375 0 CA-C-O 120.899 0.38 . . . . 0.0 111.09 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 1.1 p -174.98 178.81 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.033 179.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -127.0 92.23 3.49 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 120.636 0.255 . . . . 0.0 111.656 -179.527 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' HIS . . . . . 0.494 ' CE1' ' HB2' ' A' ' 66' ' ' ASN . 75.0 m80 -39.58 147.22 0.08 Allowed 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.902 179.816 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 18.9 p -71.9 79.89 0.9 Allowed 'General case' 0 C--N 1.334 -0.085 0 CA-C-O 120.902 0.382 . . . . 0.0 111.411 -179.467 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 4.7 p 63.31 7.48 2.91 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.734 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.424 ' O ' ' C ' ' A' ' 8' ' ' THR . . . 73.83 -55.62 0.66 Allowed 'General case' 0 N--CA 1.462 0.174 0 N-CA-C 111.909 0.336 . . . . 0.0 111.909 179.506 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.424 ' C ' ' O ' ' A' ' 7' ' ' ALA . 33.9 p . . . . . 0 N--CA 1.468 0.455 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 -179.539 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_exo . . . . . 0 CA--C 1.533 0.454 0 N-CA-C 113.144 0.401 . . . . 0.0 113.144 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_exo -46.09 177.79 0.01 OUTLIER 'Trans proline' 0 C--N 1.35 0.608 0 C-N-CA 123.196 2.598 . . . . 0.0 113.33 -179.168 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 69.39 -158.72 53.23 Favored Glycine 0 N--CA 1.451 -0.345 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.981 -179.729 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -57.96 -166.18 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 110.209 -0.293 . . . . 0.0 110.209 179.424 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . 0.488 ' HB2' ' N ' ' A' ' 46' ' ' ALA . 0.0 OUTLIER 66.23 90.38 0.09 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.186 0.517 . . . . 0.0 109.724 -179.899 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.525 ' HB3' ' HB3' ' A' ' 60' ' ' CYS . 0.7 OUTLIER -112.52 178.12 4.4 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.315 0.578 . . . . 0.0 112.13 -178.9 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.563 ' O ' ' HB2' ' A' ' 60' ' ' CYS . 12.7 m -62.62 84.94 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.264 -0.88 . . . . 0.0 112.877 -178.278 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.491 ' HB3' ' HA ' ' A' ' 59' ' ' CYS . 40.0 p90 -68.09 70.24 0.15 Allowed 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.507 0.67 . . . . 0.0 109.298 178.153 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.423 ' N ' ' O ' ' A' ' 23' ' ' CYS . 0.0 OUTLIER -41.15 147.1 0.15 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.11 -0.95 . . . . 0.0 112.948 -178.347 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -130.48 171.89 12.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 114.974 -1.012 . . . . 0.0 109.547 179.065 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 2.3 ttp -160.53 -176.55 5.64 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.916 0.389 . . . . 0.0 111.574 -179.776 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' TRP . . . . . 0.426 ' HA ' ' CE3' ' A' ' 28' ' ' TRP . 0.4 OUTLIER -100.3 -164.35 1.11 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.246 -179.948 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER 69.7 -65.37 0.31 Allowed 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.809 -179.935 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 61.97 78.51 0.29 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.25 179.659 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . 48.89 45.01 22.53 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.447 179.631 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -152.23 -170.56 3.68 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.688 179.862 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 44.89 -170.76 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.448 179.822 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 47.7 t -89.58 -28.56 19.48 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.472 179.636 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.461 ' O ' ' N ' ' A' ' 37' ' ' GLY . 1.3 p -179.74 -49.58 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.796 179.814 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 30.87 -87.22 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.329 0.652 . . . . 0.0 112.496 179.614 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.461 ' N ' ' O ' ' A' ' 35' ' ' SER . . . 62.05 -105.76 1.03 Allowed Glycine 0 C--N 1.332 0.347 0 C-N-CA 120.508 -0.853 . . . . 0.0 112.781 179.795 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.438 ' CE ' ' HB3' ' A' ' 69' ' ' PRO . 0.4 OUTLIER . . . . . 0 N--CA 1.455 -0.209 0 CA-C-O 121.174 0.511 . . . . 0.0 111.745 179.944 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . 0.475 ' C ' ' CE1' ' A' ' 24' ' ' TYR . . . . . . . . 0 N--CA 1.448 -0.542 0 CA-C-O 120.658 0.032 . . . . 0.0 113.108 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.503 ' HA ' ' O ' ' A' ' 22' ' ' LEU . 52.5 t 74.72 88.01 0.09 Allowed 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.998 0.427 . . . . 0.0 110.503 -178.94 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.436 ' HB2' ' CE1' ' A' ' 24' ' ' TYR . . . -164.68 146.37 8.18 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.729 -0.668 . . . . 0.0 111.12 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.488 ' N ' ' HB2' ' A' ' 21' ' ' ASN . . . -121.64 76.99 1.31 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.089 -179.796 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.456 ' CG2' ' HD3' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -172.49 -38.82 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.008 -179.888 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.414 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 5.7 m 59.41 52.32 3.78 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.396 179.532 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.456 ' HD3' ' CG2' ' A' ' 47' ' ' THR . 59.6 Cg_endo -71.97 -9.82 25.22 Favored 'Trans proline' 0 C--N 1.343 0.266 0 C-N-CA 122.315 2.01 . . . . 0.0 111.578 179.004 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 6.8 t -55.51 140.45 40.46 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.143 179.797 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -168.26 33.66 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.678 179.899 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.411 ' HB3' ' HD2' ' A' ' 53' ' ' PRO . 1.4 mttm -81.98 158.48 67.39 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.668 -179.887 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . 0.411 ' HD2' ' HB3' ' A' ' 52' ' ' LYS . 12.7 Cg_endo -56.35 -70.48 0.04 OUTLIER 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.527 2.151 . . . . 0.0 112.13 179.93 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.468 0.466 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.132 -179.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 3.8 t . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.735 0.302 . . . . 0.0 110.876 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . 0.491 ' HA ' ' HB3' ' A' ' 24' ' ' TYR . 1.3 m 62.1 124.09 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.975 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . 0.563 ' HB2' ' O ' ' A' ' 23' ' ' CYS . 4.6 t -84.91 -52.65 5.85 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.103 -179.679 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 53.09 99.62 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.314 179.646 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' THR . . . . . 0.416 ' HA ' ' CG2' ' A' ' 1' ' ' ILE . 46.7 p 40.69 96.66 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.902 179.689 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . 0.44 ' O ' ' CG ' ' A' ' 64' ' ' LYS . 1.0 OUTLIER 178.26 -13.14 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 179.634 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.473 ' O ' ' C ' ' A' ' 65' ' ' CYS . 3.8 ptmm? 46.65 31.75 1.48 Allowed 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 120.742 0.306 . . . . 0.0 110.839 -179.405 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . 0.473 ' C ' ' O ' ' A' ' 64' ' ' LYS . 0.1 OUTLIER -17.0 -65.36 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 115.459 -0.791 . . . . 0.0 112.674 -179.757 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.494 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 4.8 t-20 76.5 92.21 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.307 -179.848 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 12.8 Cg_exo -69.4 -171.62 0.46 Allowed 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.759 2.306 . . . . 0.0 112.109 179.83 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 7.4 p80 176.71 158.57 0.46 Allowed Pre-proline 0 C--N 1.331 -0.224 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.839 179.805 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . 0.438 ' HB3' ' CE ' ' A' ' 38' ' ' LYS . 45.1 Cg_exo -55.57 136.35 73.63 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.509 2.139 . . . . 0.0 112.139 179.908 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.403 ' HB3' ' H ' ' A' ' 38' ' ' LYS . 0.4 OUTLIER -92.79 -50.62 5.48 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.44 179.812 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 42.4 tp60 . . . . . 0 C--O 1.232 0.175 0 CA-C-O 120.846 0.355 . . . . 0.0 111.004 179.763 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 192' ' ' CYS . . . . . 0.697 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.0 OUTLIER . . . . . 0 CA--C 1.497 -1.073 0 CA-C-O 121.884 0.85 . . . . 0.0 111.587 . . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 193' ' ' CYS . . . . . 0.697 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.1 OUTLIER 43.14 81.65 0.24 Allowed Pre-proline 0 N--CA 1.439 -1.003 0 CA-C-N 113.452 -1.704 . . . . 0.0 112.161 173.75 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 194' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -86.44 30.67 0.48 Allowed 'Trans proline' 0 N--CA 1.461 -0.384 0 C-N-CA 123.054 2.503 . . . . 0.0 112.781 -179.878 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -162.45 71.57 0.32 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.876 0.369 . . . . 0.0 110.664 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 196' ' ' THR . . . . . 0.643 ' N ' ' HD3' ' B' ' 197' ' ' PRO . 65.2 p -143.36 47.93 0.88 Allowed Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.871 -179.875 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 197' ' ' PRO . . . . . 0.643 ' HD3' ' N ' ' B' ' 196' ' ' THR . 6.3 Cg_exo -73.95 13.5 0.8 Allowed 'Trans proline' 0 C--N 1.351 0.683 0 C-N-CA 121.674 1.583 . . . . 0.0 108.742 175.941 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 198' ' ' TYR . . . . . 0.614 ' H ' ' C ' ' B' ' 196' ' ' THR . 63.9 t80 . . . . . 0 C--O 1.249 1.049 0 CA-C-N 113.929 -1.487 . . . . 0.0 111.291 -178.803 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 2.1 tp . . . . . 0 N--CA 1.486 1.37 0 CA-C-O 120.593 0.235 . . . . 0.0 111.1 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -178.97 -169.04 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.566 -0.288 . . . . 0.0 110.792 -179.933 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.501 ' O ' ' CD2' ' A' ' 4' ' ' HIS . 0.9 OUTLIER -147.16 -50.26 0.19 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.712 0.291 . . . . 0.0 111.302 179.971 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' HIS . . . . . 0.501 ' CD2' ' O ' ' A' ' 3' ' ' CYS . 3.4 p80 53.95 110.28 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.244 0.545 . . . . 0.0 111.029 -179.591 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.9 t -82.7 109.95 17.33 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.552 -179.029 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.403 ' OG1' ' CE1' ' A' ' 4' ' ' HIS . 4.0 m -93.55 17.77 11.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.356 179.659 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -59.76 84.78 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.785 0.326 . . . . 0.0 110.93 179.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 2.2 p . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.896 -179.711 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.601 ' N ' ' HD2' ' A' ' 18' ' ' PRO . 74.2 Cg_exo . . . . . 0 CA--C 1.531 0.355 0 N-CA-C 112.981 0.339 . . . . 0.0 112.981 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.601 ' HD2' ' N ' ' A' ' 17' ' ' PRO . 11.2 Cg_endo -55.37 -62.14 0.3 Allowed 'Trans proline' 0 C--N 1.349 0.575 0 C-N-CA 122.345 2.03 . . . . 0.0 112.498 -179.649 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . 0.478 ' HA2' ' HA ' ' A' ' 46' ' ' ALA . . . -45.99 156.7 0.45 Allowed Glycine 0 C--N 1.331 0.25 0 C-N-CA 120.823 -0.703 . . . . 0.0 112.459 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.467 ' HG3' ' CD1' ' A' ' 22' ' ' LEU . 0.0 OUTLIER -99.4 48.96 0.94 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.031 0.444 . . . . 0.0 112.128 -179.314 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 77.72 60.52 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.744 -0.662 . . . . 0.0 112.441 178.357 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.477 ' CD2' ' O ' ' A' ' 22' ' ' LEU . 0.0 OUTLIER -152.13 96.7 2.22 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 121.003 0.43 . . . . 0.0 111.605 178.366 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.542 ' HA ' ' HA ' ' A' ' 44' ' ' CYS . 9.5 m -87.77 44.81 1.22 Allowed 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.825 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.605 ' O ' ' CB ' ' A' ' 25' ' ' ARG . 0.2 OUTLIER 35.29 -89.31 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 179.535 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.605 ' CB ' ' O ' ' A' ' 24' ' ' TYR . 12.5 ttm-85 107.08 -59.69 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.331 0.652 . . . . 0.0 111.835 -179.959 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 61.53 123.89 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.541 -179.048 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 10.0 ptt? -144.41 137.59 27.13 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.003 0.43 . . . . 0.0 111.87 -179.65 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 4.3 t90 -136.41 142.54 43.69 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.426 179.399 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . 0.465 ' HA ' ' CB ' ' A' ' 33' ' ' CYS . 33.8 t 69.94 11.13 7.67 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.51 -179.822 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -97.97 44.82 1.03 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.778 0.323 . . . . 0.0 111.072 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -178.3 -88.32 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.983 179.753 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -96.63 76.47 2.85 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.996 0.427 . . . . 0.0 110.077 179.526 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.465 ' CB ' ' HA ' ' A' ' 29' ' ' CYS . 7.2 t -161.15 156.49 24.43 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.798 -179.119 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -51.35 -54.3 27.73 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.96 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 2.6 m -86.43 168.29 13.91 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.614 179.755 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.419 ' CG ' ' O ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -100.51 63.12 1.08 Allowed 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.363 -179.637 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.446 ' N ' ' O ' ' A' ' 29' ' ' CYS . . . 78.46 144.26 2.47 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.436 -0.887 . . . . 0.0 113.118 179.498 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.595 ' HA ' ' HG2' ' A' ' 70' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.308 0 CA-C-O 121.333 0.587 . . . . 0.0 109.83 179.574 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.52 0.345 0 CA-C-O 119.921 -0.377 . . . . 0.0 113.74 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.542 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 52.5 t 61.32 152.88 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 117.602 0.701 . . . . 0.0 111.496 179.752 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.457 ' CB ' ' CE1' ' A' ' 24' ' ' TYR . . . -128.06 -79.37 0.58 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.743 179.745 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.478 ' HA ' ' HA2' ' A' ' 19' ' ' GLY . . . 168.01 -24.98 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.874 179.699 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 14.8 t -146.1 134.19 21.55 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.766 0.317 . . . . 0.0 111.438 -179.449 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.489 ' O ' ' N ' ' A' ' 50' ' ' SER . 11.3 m -78.99 -47.11 1.69 Allowed Pre-proline 0 C--N 1.333 -0.142 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.732 179.552 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.473 ' CD ' ' N ' ' A' ' 48' ' ' CYS . 17.3 Cg_exo -65.97 59.76 0.44 Allowed 'Trans proline' 0 C--N 1.349 0.585 0 C-N-CA 122.335 2.024 . . . . 0.0 110.374 178.701 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.489 ' N ' ' O ' ' A' ' 48' ' ' CYS . 23.0 t -93.65 -41.23 9.83 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 115.231 -0.895 . . . . 0.0 111.018 -178.615 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.528 ' O ' ' CB ' ' A' ' 52' ' ' LYS . 4.3 mmtm -141.47 -80.12 0.25 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.712 179.747 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.688 ' HB2' ' HD3' ' A' ' 53' ' ' PRO . 4.9 mtpp 107.29 -56.92 0.0 OUTLIER Pre-proline 0 N--CA 1.474 0.759 0 C-N-CA 123.954 0.902 . . . . 0.0 111.355 179.735 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . 0.688 ' HD3' ' HB2' ' A' ' 52' ' ' LYS . 39.4 Cg_exo -59.83 -156.65 0.02 OUTLIER 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 122.06 1.84 . . . . 0.0 111.971 179.641 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.468 0.474 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.598 179.691 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.456 -0.143 0 CA-C-O 120.916 0.389 . . . . 0.0 110.441 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 2.7 m 68.99 168.04 0.28 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.581 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . 0.445 ' HB3' ' HB2' ' A' ' 23' ' ' CYS . 0.1 OUTLIER -162.18 36.14 0.12 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.742 0.306 . . . . 0.0 111.495 -179.374 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.72 -163.0 0.18 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.655 0.264 . . . . 0.0 111.222 -179.916 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 1.4 p 77.71 27.99 0.58 Allowed 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.224 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 16.2 t70 60.68 149.66 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.572 179.288 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 29.53 87.39 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 115.631 -0.713 . . . . 0.0 112.517 179.57 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . 0.432 ' CB ' ' O ' ' A' ' 60' ' ' CYS . 49.0 t -123.4 -10.49 7.97 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.297 179.77 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.532 ' N ' ' HD2' ' A' ' 67' ' ' PRO . 12.3 m-80 -63.07 -57.06 22.87 Favored Pre-proline 0 CA--C 1.531 0.236 0 CA-C-N 116.578 -0.283 . . . . 0.0 111.534 -179.913 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . 0.532 ' HD2' ' N ' ' A' ' 66' ' ' ASN . 1.3 Cg_endo -42.83 165.4 0.03 OUTLIER 'Trans proline' 0 C--N 1.349 0.58 0 C-N-CA 122.992 2.461 . . . . 0.0 112.94 -179.65 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.499 ' N ' ' HD3' ' A' ' 69' ' ' PRO . 2.2 m-70 57.57 51.81 5.08 Favored Pre-proline 0 C--N 1.331 -0.197 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.064 -179.801 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . 0.499 ' HD3' ' N ' ' A' ' 68' ' ' HIS . 96.6 Cg_endo -86.63 -47.6 0.04 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.595 0 C-N-CA 122.479 2.12 . . . . 0.0 113.105 -179.697 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.595 ' HG2' ' HA ' ' A' ' 38' ' ' LYS . 0.0 OUTLIER -179.01 -164.12 0.07 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.662 -179.051 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.53 0.205 0 N-CA-C 111.7 0.259 . . . . 0.0 111.7 179.441 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 192' ' ' CYS . . . . . 0.697 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.0 OUTLIER . . . . . 0 CA--C 1.498 -1.029 0 CA-C-O 121.752 0.787 . . . . 0.0 110.985 . . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 193' ' ' CYS . . . . . 0.697 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.1 OUTLIER 41.31 73.36 0.9 Allowed Pre-proline 0 C--N 1.314 -0.946 0 CA-C-N 113.625 -1.625 . . . . 0.0 112.172 173.706 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 194' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -65.06 -87.42 0.0 OUTLIER 'Trans proline' 0 CA--C 1.531 0.331 0 C-N-CA 122.555 2.17 . . . . 0.0 112.391 -179.749 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 30.9 t0 -106.14 13.64 28.74 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.566 0.222 . . . . 0.0 111.539 -179.805 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 196' ' ' THR . . . . . 0.754 ' C ' ' H ' ' B' ' 198' ' ' TYR . 77.3 p -79.89 -22.32 0.36 Allowed Pre-proline 0 C--N 1.331 -0.208 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 179.951 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 197' ' ' PRO . . . . . 0.664 ' CD ' ' N ' ' B' ' 196' ' ' THR . 17.2 Cg_exo -64.73 27.87 0.08 OUTLIER 'Trans proline' 0 C--N 1.355 0.878 0 C-N-CA 121.329 1.353 . . . . 0.0 109.622 177.172 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 198' ' ' TYR . . . . . 0.754 ' H ' ' C ' ' B' ' 196' ' ' THR . 13.0 t80 . . . . . 0 C--O 1.249 1.026 0 CA-C-N 114.283 -1.326 . . . . 0.0 111.28 -178.739 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 1.2 mm . . . . . 0 N--CA 1.487 1.419 0 CA-C-O 120.758 0.313 . . . . 0.0 110.781 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -96.41 146.95 6.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.921 -179.818 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 29.2 p -127.0 116.45 20.78 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 112.37 0.507 . . . . 0.0 112.37 -178.68 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' HIS . . . . . 0.447 ' CE1' ' ND2' ' A' ' 66' ' ' ASN . 0.6 OUTLIER -46.35 166.3 0.02 OUTLIER 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.278 179.163 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 21.2 p -88.91 126.09 35.23 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.924 -179.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -121.04 28.82 7.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.069 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -48.26 -30.36 4.71 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 121.018 0.437 . . . . 0.0 111.046 179.797 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 88.0 m . . . . . 0 C--N 1.328 -0.359 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.239 179.702 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.412 ' HB3' ' O ' ' A' ' 21' ' ' ASN . 69.3 Cg_endo . . . . . 0 N--CA 1.456 -0.721 0 N-CA-C 113.723 0.624 . . . . 0.0 113.723 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.433 ' O ' ' N ' ' A' ' 20' ' ' GLU . 49.3 Cg_endo -68.56 162.86 39.1 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.013 1.809 . . . . 0.0 111.106 178.808 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 53.26 -88.45 0.01 OUTLIER Glycine 0 CA--C 1.519 0.295 0 C-N-CA 120.528 -0.844 . . . . 0.0 112.518 -179.866 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.433 ' N ' ' O ' ' A' ' 18' ' ' PRO . 14.5 mt-10 -140.07 111.82 7.41 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.807 0.337 . . . . 0.0 110.884 179.842 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . 0.493 ' O ' ' C ' ' A' ' 22' ' ' LEU . 0.7 OUTLIER -178.5 34.09 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.081 179.904 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.493 ' C ' ' O ' ' A' ' 21' ' ' ASN . 0.2 OUTLIER -12.85 124.94 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 -179.822 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.581 ' O ' ' N ' ' A' ' 44' ' ' CYS . 0.1 OUTLIER -43.65 -29.41 0.5 Allowed 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.898 -179.691 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.427 ' CD2' ' HB2' ' A' ' 45' ' ' ALA . 0.2 OUTLIER 60.58 126.4 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.997 0.427 . . . . 0.0 111.344 179.51 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 3.0 ttt180 -117.21 78.06 1.18 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.801 179.75 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 2.9 mtmm -64.67 154.55 36.2 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.13 -179.83 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 1.8 ttm -157.5 100.45 1.8 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.52 179.862 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -56.42 -36.74 69.3 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.476 -179.544 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER 59.63 -168.4 0.15 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.826 0.346 . . . . 0.0 110.72 179.914 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 26.7 p-10 -91.71 -38.3 12.49 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.816 179.847 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -171.93 -56.08 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.809 179.855 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -131.96 17.48 4.64 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.974 179.58 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 93.0 m 56.84 165.76 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.945 0.402 . . . . 0.0 111.337 179.755 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 11.4 p 172.13 -34.16 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.499 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -161.36 -43.74 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.584 179.937 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.53 -172.22 1.75 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.967 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.411 ' O ' ' C ' ' A' ' 38' ' ' LYS . . . 169.69 -38.62 0.2 Allowed Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 121.141 -0.552 . . . . 0.0 111.887 -179.844 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.645 ' HA ' ' HB2' ' A' ' 70' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.467 0.387 0 N-CA-C 113.534 0.938 . . . . 0.0 113.534 179.673 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.195 0 N-CA-C 113.241 0.056 . . . . 0.0 113.241 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.581 ' N ' ' O ' ' A' ' 23' ' ' CYS . 13.7 m 60.61 152.56 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.075 0.464 . . . . 0.0 111.659 179.045 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.427 ' HB2' ' CD2' ' A' ' 24' ' ' TYR . . . -133.0 -77.97 0.49 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.997 179.96 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 170.75 -31.26 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.347 179.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 13.5 t -141.35 -165.55 1.99 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.345 -179.686 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.468 ' H ' ' HD2' ' A' ' 49' ' ' PRO . 34.5 t -148.03 -60.46 0.02 OUTLIER Pre-proline 0 C--N 1.331 -0.205 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.494 -179.993 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.468 ' HD2' ' H ' ' A' ' 48' ' ' CYS . 3.4 Cg_exo -39.66 -26.83 0.17 Allowed 'Trans proline' 0 C--N 1.353 0.77 0 C-N-CA 122.519 2.146 . . . . 0.0 111.52 179.083 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.429 ' N ' ' O ' ' A' ' 48' ' ' CYS . 0.9 OUTLIER -41.47 136.05 1.89 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.42 178.708 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 170.63 59.81 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.915 0.388 . . . . 0.0 111.043 179.62 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.469 ' HB2' ' HD3' ' A' ' 53' ' ' PRO . 0.0 OUTLIER -97.14 -67.07 0.07 OUTLIER Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.101 179.878 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . 0.469 ' HD3' ' HB2' ' A' ' 52' ' ' LYS . 72.2 Cg_endo -76.14 166.52 27.66 Favored 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 122.132 1.888 . . . . 0.0 112.286 179.907 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.469 0.49 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.935 179.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.529 0.168 0 CA-C-O 120.771 0.319 . . . . 0.0 111.075 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 7.8 t 49.61 97.47 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.719 179.674 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . 0.412 ' HB3' ' CB ' ' A' ' 23' ' ' CYS . 21.1 t -84.71 -108.71 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 179.162 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 2.8 p 69.62 -59.22 0.5 Allowed 'General case' 0 N--CA 1.463 0.191 0 N-CA-C 111.955 0.354 . . . . 0.0 111.955 179.187 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 23.8 p -51.56 -173.55 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.938 0.399 . . . . 0.0 111.6 -179.403 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . 0.438 ' O ' ' N ' ' A' ' 65' ' ' CYS . 2.0 p30 -39.88 160.1 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.754 -179.56 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 29.6 mtpt -40.73 92.49 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.484 -179.619 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . 0.438 ' N ' ' O ' ' A' ' 63' ' ' ASP . 4.1 m -38.75 -40.78 0.65 Allowed 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.247 -179.914 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.447 ' ND2' ' CE1' ' A' ' 4' ' ' HIS . 1.0 OUTLIER 43.23 55.29 11.21 Favored Pre-proline 0 N--CA 1.463 0.196 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.577 179.621 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -71.6 -8.32 22.97 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.424 2.083 . . . . 0.0 112.532 179.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 21.7 m170 60.19 158.83 0.11 Allowed Pre-proline 0 C--N 1.332 -0.189 0 CA-C-N 116.53 -0.304 . . . . 0.0 110.591 -179.835 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . 0.407 ' HG2' ' HA ' ' B' ' 194' ' ' PRO . 67.1 Cg_exo -43.65 -66.43 0.16 Allowed 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.601 2.201 . . . . 0.0 113.106 -179.45 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.645 ' HB2' ' HA ' ' A' ' 38' ' ' LYS . 0.0 OUTLIER -134.73 178.91 6.64 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 120.645 0.26 . . . . 0.0 110.939 -179.408 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.447 ' N ' ' HG2' ' A' ' 70' ' ' LYS . 14.5 tp60 . . . . . 0 N--CA 1.463 0.218 0 N-CA-C 111.915 0.339 . . . . 0.0 111.915 -179.597 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 192' ' ' CYS . . . . . 0.724 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.2 OUTLIER . . . . . 0 CA--C 1.502 -0.871 0 CA-C-O 121.652 0.739 . . . . 0.0 112.431 . . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 193' ' ' CYS . . . . . 0.724 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.0 OUTLIER -157.45 170.98 8.06 Favored Pre-proline 0 N--CA 1.438 -1.027 0 CA-C-N 114.055 -1.43 . . . . 0.0 111.737 -173.209 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 194' ' ' PRO . . . . . 0.428 ' HD2' ' CB ' ' B' ' 193' ' ' CYS . 1.5 Cg_endo -44.36 -70.85 0.06 OUTLIER 'Trans proline' 0 C--N 1.35 0.658 0 C-N-CA 123.149 2.566 . . . . 0.0 112.807 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -144.37 -85.73 0.13 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.004 -179.682 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 196' ' ' THR . . . . . 0.613 ' C ' ' H ' ' B' ' 198' ' ' TYR . 0.2 OUTLIER -157.06 43.53 0.18 Allowed Pre-proline 0 C--N 1.332 -0.185 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.817 -179.722 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 197' ' ' PRO . . . . . 0.491 ' CD ' ' N ' ' B' ' 196' ' ' THR . 72.7 Cg_endo -74.13 17.18 0.52 Allowed 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 121.627 1.551 . . . . 0.0 109.016 176.203 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 198' ' ' TYR . . . . . 0.613 ' H ' ' C ' ' B' ' 196' ' ' THR . 29.6 t80 . . . . . 0 C--O 1.249 1.064 0 CA-C-N 113.875 -1.512 . . . . 0.0 111.357 -178.781 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 1' ' ' ILE . . . . . 0.423 ' O ' ' HB ' ' A' ' 2' ' ' VAL . 1.3 tp . . . . . 0 N--CA 1.487 1.407 0 CA-C-O 120.508 0.194 . . . . 0.0 111.079 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . 0.423 ' HB ' ' O ' ' A' ' 1' ' ' ILE . 9.9 p 177.08 147.0 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.517 -0.31 . . . . 0.0 110.847 179.902 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.41 ' N ' HG23 ' A' ' 2' ' ' VAL . 0.5 OUTLIER -154.9 131.1 10.31 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.77 0.319 . . . . 0.0 111.265 -179.847 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 59.2 m-70 -48.69 171.75 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.944 179.712 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -75.58 -167.46 0.68 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.661 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.432 ' O ' ' CB ' ' A' ' 7' ' ' ALA . 9.6 t -46.07 -25.05 0.51 Allowed 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.364 179.819 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.432 ' CB ' ' O ' ' A' ' 6' ' ' THR . . . 83.36 78.89 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.534 179.71 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.2 179.234 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.442 ' N ' ' CD ' ' A' ' 18' ' ' PRO . 28.4 Cg_exo . . . . . 0 CA--C 1.53 0.28 0 N-CA-C 112.562 0.178 . . . . 0.0 112.562 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.442 ' CD ' ' N ' ' A' ' 17' ' ' PRO . 41.5 Cg_exo -56.74 175.1 0.32 Allowed 'Trans proline' 0 C--N 1.347 0.492 0 C-N-CA 122.394 2.063 . . . . 0.0 112.351 179.935 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 55.47 -166.69 3.2 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.872 -0.68 . . . . 0.0 112.819 179.756 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -159.8 22.93 0.18 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.636 0.255 . . . . 0.0 111.064 179.869 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . 0.482 ' N ' ' O ' ' A' ' 45' ' ' ALA . 4.8 m120 -137.02 10.0 3.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.318 179.612 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.502 ' O ' ' HA ' ' A' ' 44' ' ' CYS . 0.0 OUTLIER 70.11 -172.18 0.17 Allowed 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 112.846 0.684 . . . . 0.0 112.846 178.841 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.522 ' HA ' ' HA ' ' A' ' 44' ' ' CYS . 56.3 m -59.88 175.61 0.37 Allowed 'General case' 0 N--CA 1.46 0.048 0 CA-C-N 114.863 -1.062 . . . . 0.0 112.002 -179.738 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.469 ' CE1' ' HB2' ' A' ' 48' ' ' CYS . 4.3 m-30 -119.17 -54.52 2.2 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.42 179.476 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.437 ' CG ' ' O ' ' A' ' 24' ' ' TYR . 0.0 OUTLIER 78.18 170.98 0.2 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.967 -179.041 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 177.95 74.93 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.447 -179.523 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 22.7 mtp -81.86 -176.37 6.07 Favored 'General case' 0 C--N 1.321 -0.644 0 C-N-CA 120.459 -0.496 . . . . 0.0 111.169 -179.416 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' TRP . . . . . 0.459 ' HA ' ' CE3' ' A' ' 28' ' ' TRP . 0.0 OUTLIER -133.38 86.93 2.34 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.503 179.885 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . 0.434 ' HA ' ' HG2' ' A' ' 36' ' ' ARG . 0.1 OUTLIER -148.34 66.29 1.08 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.587 -179.74 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.432 ' HB2' ' CZ3' ' A' ' 28' ' ' TRP . 1.2 t0 -52.08 90.51 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.845 -179.275 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . 38.9 -90.54 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.008 -0.542 . . . . 0.0 112.208 179.434 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . 0.426 ' N ' ' O ' ' A' ' 30' ' ' ASP . 0.2 OUTLIER -64.07 79.7 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.983 0.42 . . . . 0.0 110.758 179.998 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 66.1 m -71.04 -73.44 0.17 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.909 -179.864 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.8 m 69.04 -64.8 0.31 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.918 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 45.7 m -137.55 53.89 1.84 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.974 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.434 ' HG2' ' HA ' ' A' ' 29' ' ' CYS . 2.1 tpt180 -100.29 -149.8 0.37 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.76 179.864 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -159.92 144.4 10.06 Favored Glycine 0 C--N 1.334 0.418 0 C-N-CA 120.294 -0.955 . . . . 0.0 112.844 -179.68 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.537 ' HB2' ' CB ' ' A' ' 70' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.296 0 CA-C-O 121.135 0.493 . . . . 0.0 111.36 -179.759 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . 0.409 ' HA3' ' HB2' ' A' ' 24' ' ' TYR . . . . . . . . 0 N--CA 1.45 -0.371 0 N-CA-C 112.468 -0.253 . . . . 0.0 112.468 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.522 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 10.8 t 66.24 117.0 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.609 0.242 . . . . 0.0 110.814 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.482 ' O ' ' N ' ' A' ' 21' ' ' ASN . . . -164.51 -170.32 2.0 Favored 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 120.618 -0.433 . . . . 0.0 111.83 -179.976 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.409 ' HA ' ' HB2' ' A' ' 21' ' ' ASN . . . -132.17 34.55 3.78 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.215 -179.851 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.5 m -171.93 94.92 0.15 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.576 -179.691 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.48 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 1.8 t -147.24 46.06 0.47 Allowed Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.987 179.909 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.48 ' CD ' ' N ' ' A' ' 48' ' ' CYS . 87.0 Cg_endo -79.11 -5.38 14.43 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.396 2.064 . . . . 0.0 111.447 178.613 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 6.3 t -65.74 163.73 15.99 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.318 -179.703 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.559 ' O ' ' CB ' ' A' ' 52' ' ' LYS . 0.5 OUTLIER 172.36 175.35 0.09 Allowed 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.828 179.669 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.559 ' CB ' ' O ' ' A' ' 51' ' ' LYS . 4.8 mtpm? 115.79 -48.32 0.0 OUTLIER Pre-proline 0 N--CA 1.475 0.824 0 C-N-CA 124.171 0.989 . . . . 0.0 111.425 179.84 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . 0.482 ' HD3' ' HB2' ' A' ' 52' ' ' LYS . 24.9 Cg_exo -62.28 139.61 78.46 Favored 'Trans proline' 0 C--N 1.349 0.575 0 C-N-CA 122.131 1.887 . . . . 0.0 111.994 179.893 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.469 0.485 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.865 -179.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 4.1 p . . . . . 0 CA--C 1.53 0.18 0 N-CA-C 111.614 0.228 . . . . 0.0 111.614 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 3.9 m 58.33 150.41 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.143 0 CA-C-O 121.011 0.434 . . . . 0.0 110.937 179.62 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . 0.423 ' O ' ' O ' ' A' ' 21' ' ' ASN . 0.1 OUTLIER -122.26 138.18 54.59 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.08 -179.217 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.45 ' HA ' ' CB ' ' A' ' 22' ' ' LEU . 54.2 p -176.8 89.26 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.023 0.439 . . . . 0.0 111.062 179.572 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER 164.24 73.23 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.027 179.939 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . 0.41 ' O ' ' N ' ' A' ' 65' ' ' CYS . 0.6 OUTLIER 63.64 178.39 0.16 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.283 -179.38 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.487 ' CG ' ' O ' ' A' ' 64' ' ' LYS . 0.0 OUTLIER -52.75 90.57 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.406 0.622 . . . . 0.0 110.921 -179.912 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . 0.41 ' N ' ' O ' ' A' ' 63' ' ' ASP . 8.0 p -101.13 -11.48 19.55 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.63 -179.463 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 49.6 t30 -52.96 126.59 43.25 Favored Pre-proline 0 C--N 1.328 -0.36 0 C-N-CA 121.019 -0.272 . . . . 0.0 111.101 -179.229 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -74.04 119.39 5.82 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.526 2.151 . . . . 0.0 112.639 -179.872 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.484 ' HB3' ' HD2' ' A' ' 69' ' ' PRO . 1.7 m80 -69.83 178.51 1.0 Allowed Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.156 -0.474 . . . . 0.0 109.724 179.355 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . 0.484 ' HD2' ' HB3' ' A' ' 68' ' ' HIS . 69.8 Cg_exo -43.17 148.16 0.65 Allowed 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.438 2.092 . . . . 0.0 112.515 -179.979 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.537 ' CB ' ' HB2' ' A' ' 38' ' ' LYS . 0.0 OUTLIER -46.16 135.45 7.71 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.035 0.445 . . . . 0.0 111.257 -179.305 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 . . . . . 0 C--N 1.328 -0.346 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.551 -178.985 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 192' ' ' CYS . . . . . 0.704 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.0 OUTLIER . . . . . 0 CA--C 1.501 -0.932 0 N-CA-C 112.774 0.657 . . . . 0.0 112.774 . . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 193' ' ' CYS . . . . . 0.704 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.0 OUTLIER -162.63 155.61 16.8 Favored Pre-proline 0 N--CA 1.439 -1.006 0 CA-C-N 114.736 -1.12 . . . . 0.0 112.15 -172.986 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 194' ' ' PRO . . . . . 0.416 ' HA ' ' HG2' ' A' ' 69' ' ' PRO . 56.8 Cg_endo -98.02 137.58 0.4 Allowed 'Trans proline' 0 N--CA 1.455 -0.778 0 C-N-CA 123.384 2.723 . . . . 0.0 112.981 -179.646 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 67.97 129.77 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 121.114 0.483 . . . . 0.0 111.767 179.044 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 196' ' ' THR . . . . . 0.573 ' C ' ' H ' ' B' ' 198' ' ' TYR . 52.0 m -160.11 44.48 0.17 Allowed Pre-proline 0 C--N 1.331 -0.235 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.304 179.645 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 197' ' ' PRO . . . . . 0.508 ' CD ' ' N ' ' B' ' 196' ' ' THR . 80.9 Cg_endo -74.93 14.31 0.87 Allowed 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 121.745 1.63 . . . . 0.0 108.919 176.234 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 198' ' ' TYR . . . . . 0.573 ' H ' ' C ' ' B' ' 196' ' ' THR . 59.3 t80 . . . . . 0 C--O 1.248 1.022 0 CA-C-N 113.896 -1.502 . . . . 0.0 111.299 -178.84 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 1' ' ' ILE . . . . . 0.583 ' CG2' ' C ' ' A' ' 62' ' ' THR . 9.7 mm . . . . . 0 N--CA 1.487 1.406 0 CA-C-O 120.817 0.342 . . . . 0.0 111.156 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . 0.415 ' CG2' ' C ' ' A' ' 1' ' ' ILE . 0.0 OUTLIER 45.01 -171.64 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 CA-C-N 116.155 -0.475 . . . . 0.0 112.231 179.461 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.442 ' O ' ' O ' ' A' ' 4' ' ' HIS . 1.0 OUTLIER -148.09 125.73 11.79 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 116.554 -0.294 . . . . 0.0 110.81 -178.827 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' HIS . . . . . 0.515 ' CG ' ' HB3' ' A' ' 66' ' ' ASN . 4.2 m-70 -37.83 162.95 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 112.073 0.397 . . . . 0.0 112.073 -179.809 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.447 ' C ' ' H ' ' A' ' 7' ' ' ALA . 0.2 OUTLIER -137.85 163.36 31.62 Favored 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 112.452 0.538 . . . . 0.0 112.452 -178.354 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 8.4 p 67.23 -43.34 0.45 Allowed 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 115.378 -0.828 . . . . 0.0 111.674 -179.749 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.448 ' HB1' ' CG ' ' A' ' 67' ' ' PRO . . . 77.07 -179.76 0.14 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.725 0.298 . . . . 0.0 110.782 -179.678 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 9.3 m . . . . . 0 C--N 1.332 -0.178 0 CA-C-N 116.466 -0.333 . . . . 0.0 110.552 -179.453 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.474 ' N ' ' CD ' ' A' ' 18' ' ' PRO . 31.2 Cg_exo . . . . . 0 CA--C 1.53 0.324 0 N-CA-C 112.743 0.247 . . . . 0.0 112.743 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.474 ' CD ' ' N ' ' A' ' 17' ' ' PRO . 81.0 Cg_exo -47.56 -63.75 0.3 Allowed 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 122.535 2.157 . . . . 0.0 112.527 -179.891 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -99.43 146.84 18.14 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.186 179.805 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -138.41 29.43 2.43 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.614 0.245 . . . . 0.0 111.199 -179.742 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -141.02 85.39 1.98 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.222 -179.934 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.535 ' HA ' ' CA ' ' A' ' 61' ' ' SER . 1.4 mt 62.62 123.5 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.574 -0.284 . . . . 0.0 111.537 178.952 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.561 ' HA ' ' HA ' ' A' ' 44' ' ' CYS . 3.8 m -71.8 157.84 37.17 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-O 120.973 0.416 . . . . 0.0 110.788 179.861 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.588 ' CD2' ' O ' ' A' ' 44' ' ' CYS . 0.8 OUTLIER -65.31 65.3 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.778 -0.646 . . . . 0.0 112.012 -178.97 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.401 ' N ' ' O ' ' A' ' 23' ' ' CYS . 1.1 ttt85 -57.58 82.16 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.906 0.384 . . . . 0.0 110.45 179.215 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.486 ' N ' ' O ' ' A' ' 24' ' ' TYR . 32.8 tttt -85.18 156.59 20.94 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.383 -179.231 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -177.34 100.84 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.764 179.708 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 34.4 t-105 -56.86 -75.27 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.776 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 1.1 m 49.83 81.09 0.06 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.4 179.257 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -62.5 99.38 0.14 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.713 179.737 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . 63.76 -79.55 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.974 -179.75 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -97.32 138.56 34.59 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.601 179.664 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 22.7 m -84.93 -79.08 0.23 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.069 -179.788 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 38.7 t 64.99 -74.76 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.936 -179.904 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.413 ' HA ' ' HE2' ' A' ' 70' ' ' LYS . 1.0 OUTLIER 179.65 29.68 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.09 179.809 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -119.28 -3.16 10.55 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.528 -179.803 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -124.17 54.76 0.72 Allowed Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.57 -0.824 . . . . 0.0 113.307 -179.23 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.417 ' HG2' ' HG3' ' A' ' 70' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 116.719 0.26 . . . . 0.0 111.192 179.625 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . 0.46 ' O ' ' HB2' ' A' ' 44' ' ' CYS . . . . . . . . 0 CA--C 1.521 0.459 0 CA-C-O 120.174 -0.237 . . . . 0.0 113.542 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.588 ' O ' ' CD2' ' A' ' 24' ' ' TYR . 1.7 m 70.77 118.28 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 112.635 0.606 . . . . 0.0 112.635 179.034 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.496 ' HA ' ' CE1' ' A' ' 24' ' ' TYR . . . -122.48 174.29 7.14 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.537 179.614 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.547 ' O ' ' CG2' ' A' ' 47' ' ' THR . . . -101.76 78.71 1.85 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.479 179.77 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.547 ' CG2' ' O ' ' A' ' 46' ' ' ALA . 3.5 t 61.79 173.26 0.12 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.637 -0.71 . . . . 0.0 111.507 -179.727 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.676 ' O ' ' N ' ' A' ' 50' ' ' SER . 6.0 m -69.74 -50.77 17.06 Favored Pre-proline 0 C--N 1.331 -0.224 0 CA-C-N 116.089 -0.505 . . . . 0.0 112.287 -179.031 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.458 ' HD2' ' N ' ' A' ' 48' ' ' CYS . 42.3 Cg_exo -34.1 80.82 0.0 OUTLIER 'Trans proline' 0 C--N 1.353 0.787 0 C-N-CA 122.663 2.242 . . . . 0.0 111.622 179.838 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.676 ' N ' ' O ' ' A' ' 48' ' ' CYS . 3.6 t -161.26 -34.77 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.12 -0.945 . . . . 0.0 111.208 -177.571 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -43.08 -55.85 3.66 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.83 -179.492 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.454 ' CB ' ' CD ' ' A' ' 53' ' ' PRO . 0.0 OUTLIER -45.99 -65.68 0.63 Allowed Pre-proline 0 C--N 1.331 -0.21 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.074 -179.75 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . 0.454 ' CD ' ' CB ' ' A' ' 52' ' ' LYS . 32.7 Cg_endo -64.58 -154.12 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.088 1.858 . . . . 0.0 110.965 178.916 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.473 0.694 0 CA-C-O 120.954 0.406 . . . . 0.0 110.843 179.671 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 53.0 p . . . . . 0 N--CA 1.465 0.283 0 N-CA-C 112.711 0.634 . . . . 0.0 112.711 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . 0.417 ' HB2' ' HB3' ' A' ' 22' ' ' LEU . 0.8 OUTLIER -179.78 155.94 0.66 Allowed 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.4 -179.373 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . 0.514 ' CB ' ' HB2' ' A' ' 23' ' ' CYS . 0.0 OUTLIER -130.71 4.3 4.57 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 112.06 0.392 . . . . 0.0 112.06 -179.434 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.535 ' CA ' ' HA ' ' A' ' 22' ' ' LEU . 82.4 p 44.63 -162.26 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.241 0 N-CA-C 110.22 -0.289 . . . . 0.0 110.22 -179.17 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' THR . . . . . 0.583 ' C ' ' CG2' ' A' ' 1' ' ' ILE . 71.4 p -99.03 123.05 43.06 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 179.291 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 5.1 p30 167.67 179.19 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.908 0.385 . . . . 0.0 111.046 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.4 ' O ' ' ND2' ' A' ' 66' ' ' ASN . 0.0 OUTLIER -80.67 58.67 3.35 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.395 179.52 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . 0.459 ' O ' ' O ' ' A' ' 66' ' ' ASN . 0.6 OUTLIER -59.49 -70.88 0.14 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.613 179.983 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.515 ' HB3' ' CG ' ' A' ' 4' ' ' HIS . 14.2 p30 49.69 161.64 0.04 OUTLIER Pre-proline 0 N--CA 1.463 0.22 0 CA-C-N 115.576 -0.738 . . . . 0.0 112.413 179.761 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . 0.448 ' CG ' ' HB1' ' A' ' 7' ' ' ALA . 16.9 Cg_exo -68.64 62.16 1.2 Allowed 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 123.193 2.596 . . . . 0.0 112.6 -179.6 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 56.7 p-80 -59.22 109.39 1.87 Allowed Pre-proline 0 C--N 1.328 -0.369 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.702 179.76 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -53.3 124.72 16.36 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.305 2.003 . . . . 0.0 111.989 -179.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.417 ' HG3' ' HG2' ' A' ' 38' ' ' LYS . 0.0 OUTLIER -90.79 -2.99 57.75 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.728 -179.487 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 31.7 tt0 . . . . . 0 C--N 1.331 -0.221 0 CA-C-N 116.612 -0.267 . . . . 0.0 111.379 -179.887 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 192' ' ' CYS . . . . . 0.717 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.0 OUTLIER . . . . . 0 CA--C 1.499 -0.999 0 CA-C-O 122.162 0.982 . . . . 0.0 111.87 . . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 193' ' ' CYS . . . . . 0.717 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.1 OUTLIER 43.93 81.41 0.25 Allowed Pre-proline 0 N--CA 1.441 -0.896 0 CA-C-N 113.114 -1.857 . . . . 0.0 112.6 173.507 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 194' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -83.36 -43.27 0.08 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.552 0 C-N-CA 122.69 2.26 . . . . 0.0 112.213 179.591 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -43.48 98.88 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.498 -179.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 196' ' ' THR . . . . . 0.68 ' N ' ' HD3' ' B' ' 197' ' ' PRO . 2.9 p -149.83 45.42 0.36 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.821 179.868 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 197' ' ' PRO . . . . . 0.68 ' HD3' ' N ' ' B' ' 196' ' ' THR . 2.5 Cg_endo -77.17 11.61 2.02 Favored 'Trans proline' 0 N--CA 1.455 -0.773 0 C-N-CA 121.851 1.701 . . . . 0.0 108.537 175.981 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 198' ' ' TYR . . . . . 0.534 ' H ' ' C ' ' B' ' 196' ' ' THR . 10.9 t80 . . . . . 0 C--O 1.249 1.063 0 CA-C-N 113.746 -1.57 . . . . 0.0 111.27 -178.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 19.2 mm . . . . . 0 N--CA 1.485 1.278 0 CA-C-O 120.846 0.355 . . . . 0.0 111.132 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . 0.527 ' HA ' ' HA ' ' A' ' 15' ' ' THR . 27.7 m -136.19 169.78 19.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.99 179.839 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 3.2 t -160.31 100.65 1.36 Allowed 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 -179.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . 0.447 ' HA ' ' CG1' ' A' ' 14' ' ' VAL . 3.7 m170 -36.01 120.36 0.62 Allowed 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.48 179.392 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -84.44 99.86 10.95 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.978 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.445 ' CG2' ' N ' ' A' ' 7' ' ' ALA . 0.4 OUTLIER 81.17 -53.97 0.3 Allowed 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.213 179.784 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.489 ' O ' ' N ' ' A' ' 9' ' ' SER . . . 58.98 -96.14 0.06 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.681 -0.236 . . . . 0.0 110.884 -179.688 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.474 ' OG1' ' N ' ' A' ' 9' ' ' SER . 5.3 p 62.01 -68.87 0.06 Allowed 'General case' 0 CA--C 1.529 0.156 0 CA-C-O 120.673 0.273 . . . . 0.0 111.396 179.666 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.489 ' N ' ' O ' ' A' ' 7' ' ' ALA . 0.6 OUTLIER -136.28 -67.02 0.02 OUTLIER Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.997 179.873 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.45 ' CD ' ' CB ' ' A' ' 9' ' ' SER . 97.1 Cg_endo -77.52 -123.88 0.01 OUTLIER 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 122.13 1.887 . . . . 0.0 111.738 179.86 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.426 ' H ' ' HB2' ' A' ' 10' ' ' PRO . 18.7 tt 179.77 158.2 0.11 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.105 0 CA-C-O 120.822 0.344 . . . . 0.0 111.053 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -136.88 -172.26 3.14 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.909 179.881 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.39 91.82 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.755 -179.62 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.447 ' CG1' ' HA ' ' A' ' 4' ' ' HIS . 0.2 OUTLIER -72.93 -166.54 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.42 179.473 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.527 ' HA ' ' HA ' ' A' ' 2' ' ' VAL . 1.6 p 75.17 130.32 0.04 OUTLIER 'General case' 0 N--CA 1.462 0.173 0 CA-C-O 121.029 0.442 . . . . 0.0 111.562 179.575 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 41.5 t -113.72 94.31 32.37 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.6 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.451 ' HB2' ' HD3' ' A' ' 18' ' ' PRO . 46.2 Cg_exo -55.22 -47.66 25.01 Favored 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.549 2.166 . . . . 0.0 112.691 -179.838 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.451 ' HD3' ' HB2' ' A' ' 17' ' ' PRO . 71.8 Cg_endo -78.45 164.77 25.99 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.281 1.987 . . . . 0.0 112.36 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 48.37 87.12 0.01 OUTLIER Glycine 0 C--N 1.33 0.237 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.437 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -87.37 82.14 7.65 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.828 0.347 . . . . 0.0 111.263 -179.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.408 ' O ' ' HB2' ' A' ' 61' ' ' SER . 0.8 OUTLIER -168.38 -74.49 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.968 179.73 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.448 ' CD2' ' HB2' ' A' ' 59' ' ' CYS . 1.0 OUTLIER -125.45 154.42 42.03 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.018 -179.626 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.546 ' HA ' ' HA ' ' A' ' 44' ' ' CYS . 2.4 p -109.34 29.15 7.82 Favored 'General case' 0 CA--C 1.534 0.354 0 N-CA-C 112.228 0.455 . . . . 0.0 112.228 -179.172 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.646 ' O ' ' HB2' ' A' ' 60' ' ' CYS . 1.9 m-85 34.82 -159.25 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 122.774 0.43 . . . . 0.0 111.654 179.385 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.596 ' HB3' ' CB ' ' A' ' 41' ' ' GLU . 1.2 mtp180 97.23 117.17 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 122.591 0.356 . . . . 0.0 111.513 179.749 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.725 ' HB2' ' HA ' ' A' ' 57' ' ' VAL . 0.3 OUTLIER -147.98 -93.82 0.08 Allowed 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.236 178.725 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 1.9 mtm 172.15 -164.12 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.255 0 C-N-CA 121.108 -0.237 . . . . 0.0 110.773 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' TRP . . . . . 0.464 ' HB3' ' CG1' ' A' ' 39' ' ' VAL . 18.1 t-105 -133.18 -84.53 0.46 Allowed 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 116.592 -0.276 . . . . 0.0 111.062 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER 54.53 175.14 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 120.813 0.339 . . . . 0.0 110.726 -179.63 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -86.21 -76.23 0.35 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.983 0.421 . . . . 0.0 110.277 179.456 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -118.1 -130.67 0.3 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.854 179.251 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.468 ' O ' ' N ' ' A' ' 34' ' ' SER . 26.7 p90 -68.47 -35.89 78.19 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 179.121 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER 34.62 -86.19 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 115.345 -0.843 . . . . 0.0 112.771 179.485 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.468 ' N ' ' O ' ' A' ' 32' ' ' PHE . 0.3 OUTLIER 78.32 28.54 0.48 Allowed 'General case' 0 N--CA 1.462 0.173 0 CA-C-O 120.967 0.413 . . . . 0.0 110.338 -179.175 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 1.6 p -152.95 -66.41 0.16 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.621 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.4 ' HG3' ' N ' ' A' ' 37' ' ' GLY . 0.2 OUTLIER -86.45 -155.36 0.25 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.718 179.821 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.4 ' N ' ' HG3' ' A' ' 36' ' ' ARG . . . 88.91 20.19 47.88 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.711 -0.756 . . . . 0.0 112.49 -179.574 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.433 ' HA ' ' HG3' ' A' ' 70' ' ' LYS . 0.1 OUTLIER -39.38 95.33 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 121.227 0.537 . . . . 0.0 111.629 -179.726 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.464 ' CG1' ' HB3' ' A' ' 28' ' ' TRP . 30.2 m -145.75 -151.53 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.436 -0.802 . . . . 0.0 109.666 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.489 ' CG2' ' HB2' ' B' ' 189' ' ' TYR . 0.2 OUTLIER -150.03 -171.18 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.11 0 C-N-CA 120.368 -0.533 . . . . 0.0 112.028 -179.995 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.596 ' CB ' ' HB3' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -108.06 155.2 20.65 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.297 -178.629 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.474 ' CD1' ' CG1' ' A' ' 57' ' ' VAL . 0.5 OUTLIER -64.46 -88.08 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 111.869 0.322 . . . . 0.0 111.869 -179.71 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.45 ' N ' ' HG2' ' A' ' 25' ' ' ARG . . . 126.91 83.94 0.48 Allowed Glycine 0 C--N 1.335 0.518 0 C-N-CA 119.664 -1.255 . . . . 0.0 113.336 179.753 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.546 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 0.1 OUTLIER 62.79 144.66 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.17 0.509 . . . . 0.0 112.286 178.819 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.476 ' HB2' ' CD2' ' A' ' 24' ' ' TYR . . . -147.06 -68.78 0.25 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.747 179.33 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 166.14 -37.01 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.666 179.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 10.4 t -178.78 173.21 1.27 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.637 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.518 ' N ' ' HD3' ' A' ' 49' ' ' PRO . 22.3 p -142.76 52.81 2.42 Favored Pre-proline 0 C--N 1.331 -0.196 0 N-CA-C 111.995 0.369 . . . . 0.0 111.995 -179.778 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.518 ' HD3' ' N ' ' A' ' 48' ' ' CYS . 32.3 Cg_exo -57.52 -21.64 47.11 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 121.849 1.699 . . . . 0.0 110.82 178.526 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 3.5 t -61.46 -166.91 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.248 -0.887 . . . . 0.0 111.108 179.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 2.0 ptmm? 177.86 39.91 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.706 179.779 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.429 ' HD2' ' O ' ' A' ' 52' ' ' LYS . 0.0 OUTLIER -76.92 154.99 83.05 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.141 -179.924 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -71.19 -89.58 0.0 OUTLIER 'Trans proline' 0 CA--C 1.531 0.365 0 C-N-CA 122.457 2.105 . . . . 0.0 112.184 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -81.08 127.43 32.61 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 120.597 0.237 . . . . 0.0 110.603 179.779 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.499 ' O ' ' HB2' ' A' ' 56' ' ' GLU . 3.1 mm-40 -156.07 -78.61 0.09 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.478 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.499 ' HB2' ' O ' ' A' ' 55' ' ' GLU . 13.4 tt0 166.34 -28.36 0.0 OUTLIER 'General case' 0 C--N 1.334 -0.089 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.896 -179.663 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.725 ' HA ' ' HB2' ' A' ' 26' ' ' LYS . 0.3 OUTLIER -167.97 160.03 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.174 0 CA-C-O 121.386 0.612 . . . . 0.0 111.929 179.962 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.471 ' N ' HG22 ' A' ' 57' ' ' VAL . 0.2 OUTLIER -122.84 -67.42 0.95 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 114.957 -1.02 . . . . 0.0 109.967 179.192 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . 0.457 ' HB3' ' HB3' ' A' ' 48' ' ' CYS . 1.3 p 178.73 146.88 0.17 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.552 179.425 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.646 ' HB2' ' O ' ' A' ' 24' ' ' TYR . 11.9 m -133.96 84.68 2.14 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.462 -179.256 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.419 ' CB ' ' CD2' ' A' ' 22' ' ' LEU . 2.1 t -93.58 74.75 4.4 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.91 0.386 . . . . 0.0 110.832 179.879 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -157.95 -164.28 1.49 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.7 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 10.8 p-10 -124.61 28.25 6.63 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.197 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.404 ' HA ' ' CE1' ' A' ' 4' ' ' HIS . 0.6 OUTLIER 179.54 43.81 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.05 0.452 . . . . 0.0 110.776 179.776 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . 0.402 ' O ' ' HD3' ' A' ' 67' ' ' PRO . 13.5 t -77.79 -27.23 50.15 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.084 -179.91 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -58.52 105.32 0.52 Allowed Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.456 -179.65 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . 0.402 ' HD3' ' O ' ' A' ' 65' ' ' CYS . 7.1 Cg_exo -73.51 -156.16 0.05 OUTLIER 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.757 2.305 . . . . 0.0 111.908 179.576 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.418 ' CB ' ' HD2' ' A' ' 69' ' ' PRO . 0.7 OUTLIER -106.77 166.59 10.85 Favored Pre-proline 0 C--N 1.331 -0.211 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.818 179.831 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . 0.418 ' HD2' ' CB ' ' A' ' 68' ' ' HIS . 9.9 Cg_endo -53.47 177.33 0.07 OUTLIER 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.619 2.212 . . . . 0.0 112.528 -179.845 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.433 ' HG3' ' HA ' ' A' ' 38' ' ' LYS . 3.0 mmpt? -85.11 -56.48 3.53 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.351 -179.623 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 31.7 mt-30 -42.74 -65.21 0.5 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.446 -179.682 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -122.34 88.73 49.0 Favored Pre-proline 0 C--N 1.33 -0.255 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.821 179.76 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -75.42 -44.44 0.31 Allowed 'Trans proline' 0 C--N 1.343 0.287 0 C-N-CA 122.576 2.184 . . . . 0.0 112.387 -179.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.094 0 CA-C-O 118.367 -1.241 . . . . 0.0 112.426 -179.968 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 181' ' ' TYR . . . . . . . . . . . . . 24.0 m-85 . . . . . 0 N--CA 1.487 1.41 0 CA-C-O 120.814 0.34 . . . . 0.0 111.157 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 182' ' ' ARG . . . . . . . . . . . . . 7.5 tpp180 -99.76 133.28 44.34 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.942 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 183' ' ' GLY . . . . . . . . . . . . . . . -145.67 -46.18 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.586 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 184' ' ' TRP . . . . . 0.41 ' HA ' ' CE3' ' B' ' 184' ' ' TRP . 4.2 m95 59.74 23.13 11.99 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.785 0.326 . . . . 0.0 110.989 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 185' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -47.56 158.43 0.19 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.251 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 186' ' ' HIS . . . . . . . . . . . . . 2.5 t-160 -89.27 126.97 35.73 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.958 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 187' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -47.24 -89.53 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.924 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -79.83 -171.48 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.67 0.271 . . . . 0.0 110.469 179.587 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 189' ' ' TYR . . . . . 0.489 ' HB2' ' CG2' ' A' ' 40' ' ' VAL . 0.0 OUTLIER -100.63 -165.75 1.24 Allowed 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 116.575 -0.284 . . . . 0.0 110.504 -179.822 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 190' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -146.02 145.76 30.72 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.817 0.342 . . . . 0.0 111.046 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 191' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -89.62 -76.27 0.42 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.253 -179.708 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 192' ' ' CYS . . . . . 0.702 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.0 OUTLIER -42.93 170.27 0.0 OUTLIER 'General case' 0 CA--C 1.499 -0.988 0 CA-C-O 122.06 0.933 . . . . 0.0 112.101 -179.738 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 193' ' ' CYS . . . . . 0.702 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.1 OUTLIER 41.09 68.6 2.37 Favored Pre-proline 0 C--N 1.314 -0.948 0 CA-C-N 113.149 -1.842 . . . . 0.0 112.209 173.817 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 194' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -73.1 -70.72 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.845 2.363 . . . . 0.0 112.422 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 166.56 -20.69 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.465 -179.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 196' ' ' THR . . . . . 0.774 ' C ' ' H ' ' B' ' 198' ' ' TYR . 0.6 OUTLIER -79.36 -20.84 0.33 Allowed Pre-proline 0 C--N 1.331 -0.198 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -179.744 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 197' ' ' PRO . . . . . 0.685 ' CD ' ' N ' ' B' ' 196' ' ' THR . 17.8 Cg_exo -64.26 25.13 0.07 OUTLIER 'Trans proline' 0 C--N 1.353 0.815 0 C-N-CA 121.218 1.279 . . . . 0.0 109.575 176.733 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 198' ' ' TYR . . . . . 0.774 ' H ' ' C ' ' B' ' 196' ' ' THR . 5.6 t80 . . . . . 0 C--O 1.248 1.022 0 CA-C-N 114.372 -1.285 . . . . 0.0 111.346 -178.74 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . 0.46 HG22 HD11 ' A' ' 1' ' ' ILE . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.375 0 CA-C-O 120.989 0.423 . . . . 0.0 111.131 . . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . 0.427 ' HB ' HG21 ' A' ' 14' ' ' VAL . 9.9 m -132.38 -179.56 3.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.351 179.496 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.501 ' N ' HG21 ' A' ' 14' ' ' VAL . 7.9 t -135.16 118.09 16.29 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.594 -0.442 . . . . 0.0 112.114 -179.927 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . 0.562 ' CA ' ' HB ' ' A' ' 14' ' ' VAL . 1.3 m-70 -35.07 143.55 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.343 179.356 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.423 ' OG1' ' HB ' ' A' ' 11' ' ' ILE . 0.2 OUTLIER -57.34 -164.23 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.47 -179.306 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 13.9 t -90.6 42.64 1.11 Allowed 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 112.295 0.479 . . . . 0.0 112.295 -178.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.466 ' CB ' ' CG2' ' A' ' 11' ' ' ILE . . . -150.52 -178.6 6.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.53 0.205 . . . . 0.0 111.003 179.312 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.538 HG23 ' HD3' ' A' ' 10' ' ' PRO . 0.5 OUTLIER -58.46 -109.44 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 116.687 -0.233 . . . . 0.0 110.966 -179.521 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.644 ' N ' ' CD ' ' A' ' 10' ' ' PRO . 81.6 p -122.92 0.86 0.06 OUTLIER Pre-proline 0 CA--C 1.545 0.772 0 N-CA-C 114.791 1.404 . . . . 0.0 114.791 -178.951 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.644 ' CD ' ' N ' ' A' ' 9' ' ' SER . 77.4 Cg_endo -78.74 -23.28 8.32 Favored 'Trans proline' 0 C--N 1.355 0.877 0 C-N-CA 121.549 1.5 . . . . 0.0 111.98 179.878 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.466 ' CG2' ' CB ' ' A' ' 7' ' ' ALA . 0.1 OUTLIER -53.18 -163.96 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.625 -0.716 . . . . 0.0 112.068 -179.38 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.4 t -173.33 -36.56 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.859 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.27 66.46 0.11 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.796 179.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.562 ' HB ' ' CA ' ' A' ' 4' ' ' HIS . 0.5 OUTLIER -112.83 135.51 52.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.764 -179.761 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.621 ' OG1' ' CD ' ' A' ' 17' ' ' PRO . 1.7 t 157.11 125.61 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 116.007 -0.542 . . . . 0.0 109.607 -179.177 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.632 ' N ' ' CD ' ' A' ' 17' ' ' PRO . 0.5 OUTLIER -117.59 26.21 0.11 Allowed Pre-proline 0 CA--C 1.542 0.669 0 N-CA-C 113.757 1.021 . . . . 0.0 113.757 -178.364 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.632 ' CD ' ' N ' ' A' ' 16' ' ' CYS . 77.9 Cg_exo -46.07 -49.78 10.83 Favored 'Trans proline' 0 C--N 1.349 0.572 0 C-N-CA 122.416 2.077 . . . . 0.0 113.461 179.615 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.614 ' HD2' ' N ' ' A' ' 17' ' ' PRO . 5.7 Cg_endo -48.97 -177.49 0.01 OUTLIER 'Trans proline' 0 C--N 1.351 0.685 0 C-N-CA 122.527 2.152 . . . . 0.0 112.766 -179.209 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.406 ' O ' ' CB ' ' A' ' 20' ' ' GLU . . . -42.25 91.03 0.01 OUTLIER Glycine 0 C--N 1.334 0.452 0 CA-C-N 116.0 -0.546 . . . . 0.0 113.164 -179.606 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.439 ' N ' ' O ' ' A' ' 18' ' ' PRO . 1.6 mt-10 162.95 -173.46 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 122.595 0.358 . . . . 0.0 110.2 -179.87 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 8.1 m-20 -178.94 -79.47 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.806 0.336 . . . . 0.0 111.194 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.512 ' O ' ' HA ' ' A' ' 44' ' ' CYS . 3.5 tm? -59.05 91.72 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.316 -179.725 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.533 ' HA ' ' HA ' ' A' ' 44' ' ' CYS . 4.6 t -66.02 63.06 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 120.738 0.304 . . . . 0.0 111.272 179.828 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.472 ' CE1' ' HA3' ' A' ' 43' ' ' GLY . 6.7 p90 -47.88 145.27 3.0 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.019 0.438 . . . . 0.0 111.933 -179.62 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.26 137.76 37.8 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.485 179.744 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -78.25 150.48 33.4 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.955 -179.886 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' MET . . . . . 0.432 ' O ' ' N ' ' A' ' 29' ' ' CYS . 14.7 ptm -143.54 79.29 1.63 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.976 179.885 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' TRP . . . . . 0.552 ' HB2' HG12 ' A' ' 39' ' ' VAL . 69.2 t-105 -58.63 79.77 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.341 -179.831 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . 0.432 ' N ' ' O ' ' A' ' 27' ' ' MET . 0.5 OUTLIER -170.02 119.02 0.6 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.074 179.762 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.79 -162.01 0.59 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.77 179.949 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -56.37 -38.13 71.01 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.328 -179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 27.3 m-85 -102.96 -79.17 0.53 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.921 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.477 ' O ' ' N ' ' A' ' 35' ' ' SER . 19.5 p 38.22 30.77 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 112.208 0.447 . . . . 0.0 112.208 179.773 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.3 m 48.46 -86.9 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 116.594 -0.276 . . . . 0.0 111.392 -179.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.477 ' N ' ' O ' ' A' ' 33' ' ' CYS . 97.6 p -176.49 71.23 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.787 0.327 . . . . 0.0 110.841 179.803 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 20.8 mtt180 -115.05 -87.93 0.58 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.1 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.404 ' HA2' ' O ' ' A' ' 28' ' ' TRP . . . 51.6 23.32 9.63 Favored Glycine 0 C--N 1.334 0.431 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.996 179.883 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.547 ' CB ' ' HG3' ' A' ' 70' ' ' LYS . 0.0 OUTLIER -82.31 51.14 1.75 Allowed 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 -179.422 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.552 HG12 ' HB2' ' A' ' 28' ' ' TRP . 3.2 p -135.41 12.39 1.05 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 CA-C-O 120.683 0.277 . . . . 0.0 110.993 179.089 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 12.5 p -47.57 153.37 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.334 -0.107 0 CA-C-O 121.185 0.517 . . . . 0.0 112.185 -179.101 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -174.68 131.32 0.34 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.282 179.819 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -50.22 176.6 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.367 -179.503 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.472 ' HA3' ' CE1' ' A' ' 24' ' ' TYR . . . -159.69 -68.97 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.316 -0.945 . . . . 0.0 113.522 -179.529 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.533 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 0.0 OUTLIER 70.41 99.53 0.06 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.239 0.543 . . . . 0.0 111.277 -179.263 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -128.4 -139.49 0.24 Allowed 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 115.342 -0.845 . . . . 0.0 110.09 179.747 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -167.98 36.53 0.03 OUTLIER 'General case' 0 C--N 1.334 -0.1 0 O-C-N 122.253 -0.28 . . . . 0.0 111.658 179.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 6.8 t -176.81 40.89 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 120.99 -0.284 . . . . 0.0 111.718 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 63.5 m 39.24 73.23 0.83 Allowed Pre-proline 0 N--CA 1.466 0.355 0 CA-C-N 116.731 -0.213 . . . . 0.0 111.538 179.712 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -53.14 -19.08 11.32 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.128 1.886 . . . . 0.0 110.847 178.601 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.445 ' HB2' ' HA ' ' A' ' 58' ' ' THR . 39.5 t -38.24 -74.19 0.04 OUTLIER 'General case' 0 N--CA 1.457 -0.088 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.983 179.347 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 23.3 mmtt 67.89 -161.87 0.21 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.581 -179.705 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.599 ' CB ' ' CD ' ' A' ' 53' ' ' PRO . 9.5 mmmt -96.6 -163.72 0.05 OUTLIER Pre-proline 0 CA--C 1.539 0.533 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.617 -179.522 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . 0.599 ' CD ' ' CB ' ' A' ' 52' ' ' LYS . 35.5 Cg_exo -39.98 -28.3 0.25 Allowed 'Trans proline' 0 C--N 1.356 0.945 0 C-N-CA 122.644 2.229 . . . . 0.0 114.484 -178.587 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . 0.455 ' CZ ' ' HB2' ' A' ' 52' ' ' LYS . 0.1 OUTLIER -50.16 -25.45 3.57 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 120.556 -0.458 . . . . 0.0 111.422 -179.723 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -135.92 -170.65 2.68 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.936 0.398 . . . . 0.0 111.033 179.526 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -126.01 -30.77 2.93 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.964 -179.924 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.471 HG13 ' CD1' ' A' ' 24' ' ' TYR . 1.4 t -44.1 167.74 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.334 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.964 -179.422 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.445 ' HA ' ' HB2' ' A' ' 50' ' ' SER . 0.0 OUTLIER -146.12 127.91 15.33 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.412 179.855 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . 0.401 ' SG ' HD23 ' A' ' 22' ' ' LEU . 1.6 t -50.63 105.79 0.11 Allowed 'General case' 0 C--O 1.232 0.183 0 CA-C-O 121.025 0.44 . . . . 0.0 110.239 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.446 ' N ' HD23 ' A' ' 22' ' ' LEU . 0.5 OUTLIER -78.31 -97.04 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 115.902 -0.59 . . . . 0.0 112.315 -178.522 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.481 ' N ' HD22 ' A' ' 22' ' ' LEU . 13.1 t 39.1 88.18 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 111.608 0.225 . . . . 0.0 111.608 -179.516 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER 175.75 -59.49 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 111.791 0.293 . . . . 0.0 111.791 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -130.76 -158.8 0.92 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.784 0.326 . . . . 0.0 111.381 -179.251 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.455 ' CB ' ' CD2' ' A' ' 4' ' ' HIS . 0.7 OUTLIER -77.49 -2.43 35.44 Favored 'General case' 0 N--CA 1.461 0.124 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.975 -179.467 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 56.1 m 36.02 42.26 0.16 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.952 -0.567 . . . . 0.0 112.354 179.39 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -133.4 53.03 9.5 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 120.695 0.283 . . . . 0.0 111.491 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -79.81 -167.55 0.52 Allowed 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.534 2.156 . . . . 0.0 112.184 179.532 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 41.8 m80 -68.97 112.1 10.49 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.671 179.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_exo -60.9 -67.14 0.05 OUTLIER 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.476 2.117 . . . . 0.0 112.517 -179.536 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.547 ' HG3' ' CB ' ' A' ' 38' ' ' LYS . 1.0 OUTLIER -73.76 145.97 44.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.011 0.434 . . . . 0.0 111.087 -179.71 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -96.35 38.44 1.2 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.212 -179.715 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER 58.12 164.84 0.08 OUTLIER Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.898 179.887 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -54.27 120.87 8.69 Favored 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.598 2.199 . . . . 0.0 112.31 -179.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.392 -1.227 . . . . 0.0 112.47 179.978 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 181' ' ' TYR . . . . . . . . . . . . . 83.1 t80 . . . . . 0 N--CA 1.486 1.364 0 CA-C-O 120.868 0.366 . . . . 0.0 111.177 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 182' ' ' ARG . . . . . . . . . . . . . 16.1 mtp85 -60.01 -67.84 0.35 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.813 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 183' ' ' GLY . . . . . 0.489 ' O ' ' CG ' ' B' ' 184' ' ' TRP . . . 57.81 163.93 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.775 179.793 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 184' ' ' TRP . . . . . 0.489 ' CG ' ' O ' ' B' ' 183' ' ' GLY . 2.4 p90 51.76 169.86 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.181 0.515 . . . . 0.0 111.87 179.885 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 185' ' ' LYS . . . . . . . . . . . . . 2.0 ptmt 171.59 -41.76 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.406 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 186' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -128.23 86.87 2.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.431 179.6 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 187' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -51.6 -84.88 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.681 -179.372 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 188' ' ' VAL . . . . . 0.413 HG23 ' O ' ' A' ' 38' ' ' LYS . 2.8 p -95.93 143.05 12.83 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.411 0 CA-C-O 120.934 0.397 . . . . 0.0 111.476 -179.259 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 189' ' ' TYR . . . . . 0.441 ' O ' ' HA ' ' A' ' 39' ' ' VAL . 13.4 p90 -106.86 103.49 12.93 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.762 -179.501 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 190' ' ' TYR . . . . . 0.407 ' HB3' ' O ' ' A' ' 38' ' ' LYS . 0.3 OUTLIER -95.82 161.13 14.14 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.735 179.284 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 191' ' ' THR . . . . . 0.407 ' O ' ' HG3' ' B' ' 194' ' ' PRO . 91.1 m -80.35 -2.5 45.71 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.318 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 192' ' ' CYS . . . . . 0.685 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.0 OUTLIER -88.62 169.24 11.87 Favored 'General case' 0 CA--C 1.498 -1.034 0 CA-C-O 122.132 0.968 . . . . 0.0 111.399 179.816 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 193' ' ' CYS . . . . . 0.685 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.1 OUTLIER 38.61 48.09 1.5 Allowed Pre-proline 0 C--N 1.314 -0.942 0 CA-C-N 112.995 -1.911 . . . . 0.0 112.843 174.12 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 194' ' ' PRO . . . . . 0.679 ' HD3' ' N ' ' B' ' 193' ' ' CYS . 57.3 Cg_endo -100.67 -69.6 0.0 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.966 0 C-N-CA 123.602 2.868 . . . . 0.0 112.838 -179.452 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -70.46 -84.75 0.03 OUTLIER 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.153 -0.476 . . . . 0.0 112.012 -179.131 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 196' ' ' THR . . . . . 0.636 ' C ' ' H ' ' B' ' 198' ' ' TYR . 10.2 t -160.17 52.04 0.43 Allowed Pre-proline 0 C--N 1.332 -0.16 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 -179.089 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 197' ' ' PRO . . . . . 0.588 ' HD3' ' N ' ' B' ' 196' ' ' THR . 2.6 Cg_exo -73.08 15.89 0.46 Allowed 'Trans proline' 0 N--CA 1.459 -0.514 0 C-N-CA 121.879 1.72 . . . . 0.0 108.73 175.848 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 198' ' ' TYR . . . . . 0.636 ' H ' ' C ' ' B' ' 196' ' ' THR . 51.4 t80 . . . . . 0 C--O 1.25 1.079 0 CA-C-N 113.939 -1.482 . . . . 0.0 111.176 -178.6 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 24.5 mm . . . . . 0 N--CA 1.486 1.355 0 CA-C-O 120.789 0.328 . . . . 0.0 111.068 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -155.0 -176.18 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.901 179.872 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 21.6 m -103.45 -174.63 2.59 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.147 0.499 . . . . 0.0 111.561 -179.537 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . 0.5 ' CD2' ' O ' ' A' ' 4' ' ' HIS . 4.3 t60 -139.53 97.59 3.31 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.925 179.307 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.1 m 28.63 36.78 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 114.673 -1.149 . . . . 0.0 112.71 -179.736 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.473 ' N ' ' O ' ' A' ' 4' ' ' HIS . 21.0 m 48.94 21.67 0.49 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.604 0.24 . . . . 0.0 111.624 -179.813 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 44.61 30.07 0.48 Allowed 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 120.756 0.313 . . . . 0.0 111.51 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 30.2 m -121.89 -70.88 0.76 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.864 -179.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.417 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.3 OUTLIER -75.81 165.91 49.43 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.626 179.831 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.417 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 6.3 Cg_endo -48.57 -73.73 0.04 OUTLIER 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.753 2.302 . . . . 0.0 112.103 179.884 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -150.1 146.43 16.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.829 179.609 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -170.2 154.16 4.82 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.87 -179.955 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -77.5 62.0 2.38 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.038 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -40.58 -83.23 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.385 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.621 -179.802 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 31.0 p 47.57 89.4 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 120.795 0.331 . . . . 0.0 111.109 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 10.0 t -59.44 136.05 88.94 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.022 -179.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -52.89 168.2 0.53 Allowed 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.433 2.089 . . . . 0.0 112.297 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -63.58 161.21 32.66 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.509 2.139 . . . . 0.0 112.214 179.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 46.78 70.85 0.61 Allowed Glycine 0 CA--C 1.518 0.23 0 C-N-CA 120.957 -0.639 . . . . 0.0 112.66 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -151.2 -177.28 5.95 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.894 0.378 . . . . 0.0 111.046 -179.785 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.431 ' HB3' ' CB ' ' A' ' 45' ' ' ALA . 0.8 OUTLIER -107.25 69.59 0.76 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.959 -179.954 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.439 ' CG ' ' HA ' ' A' ' 61' ' ' SER . 0.2 OUTLIER 49.88 -96.41 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.795 -0.639 . . . . 0.0 112.256 179.585 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.526 ' C ' ' H ' ' A' ' 44' ' ' CYS . 0.9 OUTLIER -158.66 30.76 0.23 Allowed 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 113.268 0.84 . . . . 0.0 113.268 -178.485 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.542 ' HB3' ' HA ' ' A' ' 42' ' ' LEU . 0.1 OUTLIER 55.07 161.21 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 118.2 0.454 . . . . 0.0 110.788 178.624 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.542 ' H ' HG21 ' A' ' 57' ' ' VAL . 0.8 OUTLIER -150.93 63.32 0.92 Allowed 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.503 0.557 . . . . 0.0 112.503 179.841 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.683 ' HA ' HG13 ' A' ' 57' ' ' VAL . 0.5 OUTLIER -51.02 132.93 27.69 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.087 0.47 . . . . 0.0 111.62 179.853 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 2.7 ptp -152.96 110.34 3.53 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.342 179.578 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' TRP . . . . . 0.414 ' O ' ' N ' ' A' ' 30' ' ' ASP . 26.4 t90 -79.89 -78.77 0.16 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.583 -179.314 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . 0.451 ' HB3' ' H ' ' A' ' 30' ' ' ASP . 2.4 t 52.62 -89.98 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.303 -178.995 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.451 ' H ' ' HB3' ' A' ' 29' ' ' CYS . 82.9 m-20 44.93 -177.31 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 120.953 0.406 . . . . 0.0 111.894 179.223 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . 39.45 -145.72 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.405 179.757 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -92.49 44.72 1.17 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.872 0.367 . . . . 0.0 110.889 179.707 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 6.2 p -55.66 125.49 21.37 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.796 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 2.8 m -48.22 -52.94 18.78 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.513 -179.679 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.412 ' CB ' ' HB2' ' A' ' 70' ' ' LYS . 1.3 m -137.79 166.96 22.72 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.041 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 2.5 mtm-85 -89.32 108.66 19.75 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.899 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.4 ' N ' ' HB3' ' A' ' 70' ' ' LYS . . . 163.46 -163.54 35.69 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.404 -0.903 . . . . 0.0 112.579 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 56.58 168.69 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.686 0.279 . . . . 0.0 110.702 -179.816 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 18.3 t 62.88 27.65 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 121.024 0.44 . . . . 0.0 110.232 -179.029 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 33.7 m -67.54 -177.43 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.762 -179.463 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 177.61 -63.34 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.52 179.882 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.542 ' HA ' ' HB3' ' A' ' 24' ' ' TYR . 0.4 OUTLIER 56.59 169.57 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.95 179.788 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 152.9 36.64 0.03 OUTLIER Glycine 0 CA--C 1.523 0.555 0 C-N-CA 119.985 -1.102 . . . . 0.0 114.358 179.58 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.526 ' H ' ' C ' ' A' ' 23' ' ' CYS . 87.6 m 58.69 114.93 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 117.128 0.464 . . . . 0.0 111.611 179.122 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.45 ' HA ' ' CE2' ' A' ' 24' ' ' TYR . . . -85.84 169.65 13.14 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.964 179.639 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -110.34 -39.28 5.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.821 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.449 ' OG1' ' HD3' ' A' ' 49' ' ' PRO . 11.7 t -138.53 164.3 29.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.112 179.724 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.594 ' N ' ' HD3' ' A' ' 49' ' ' PRO . 0.9 OUTLIER -132.59 44.45 1.33 Allowed Pre-proline 0 CA--C 1.532 0.254 0 N-CA-C 112.762 0.652 . . . . 0.0 112.762 -179.077 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.594 ' HD3' ' N ' ' A' ' 48' ' ' CYS . 55.4 Cg_endo -91.43 18.38 1.22 Allowed 'Trans proline' 0 N--CA 1.455 -0.789 0 C-N-CA 122.517 2.144 . . . . 0.0 110.518 177.817 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.462 ' O ' ' CD ' ' A' ' 52' ' ' LYS . 9.8 t -105.71 -112.99 0.26 Allowed 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 115.283 -0.871 . . . . 0.0 111.427 -178.412 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.436 ' CG ' ' O ' ' A' ' 50' ' ' SER . 0.6 OUTLIER 51.99 24.94 2.85 Favored 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 122.437 0.295 . . . . 0.0 111.681 -179.847 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.711 ' HB2' ' HD3' ' A' ' 53' ' ' PRO . 0.3 OUTLIER -143.3 -54.19 0.02 OUTLIER Pre-proline 0 CA--C 1.533 0.301 0 N-CA-C 111.935 0.346 . . . . 0.0 111.935 179.527 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . 0.711 ' HD3' ' HB2' ' A' ' 52' ' ' LYS . 15.3 Cg_exo -69.3 153.62 70.76 Favored 'Trans proline' 0 C--N 1.35 0.639 0 C-N-CA 122.253 1.969 . . . . 0.0 112.565 -179.633 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -77.14 75.29 3.71 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.505 179.777 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -105.71 -67.95 0.9 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.01 -179.49 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 173.55 -36.64 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.621 -179.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.683 HG13 ' HA ' ' A' ' 26' ' ' LYS . 2.4 p 179.69 -100.45 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.404 0 CA-C-N 115.949 -0.568 . . . . 0.0 111.491 179.697 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.639 ' H ' ' CG1' ' A' ' 57' ' ' VAL . 0.2 OUTLIER 85.98 31.17 0.04 OUTLIER 'General case' 0 CA--C 1.52 -0.186 0 C-N-CA 123.285 0.634 . . . . 0.0 110.902 -179.455 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . 0.479 ' SG ' ' O ' ' A' ' 58' ' ' THR . 15.4 m -167.94 158.51 10.65 Favored 'General case' 0 CA--C 1.528 0.117 0 CA-C-O 121.741 0.781 . . . . 0.0 112.814 179.716 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.425 ' O ' ' CB ' ' A' ' 22' ' ' LEU . 0.2 OUTLIER 170.47 129.35 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 114.241 -1.345 . . . . 0.0 109.159 178.646 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.439 ' HA ' ' CG ' ' A' ' 22' ' ' LEU . 16.1 p -176.78 170.55 2.34 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.916 0.388 . . . . 0.0 111.336 -179.238 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER 48.73 38.2 11.2 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.45 179.803 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 179.01 -174.64 0.19 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.769 179.813 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.425 ' HB2' ' ND2' ' A' ' 66' ' ' ASN . 12.8 mmtm -101.91 17.99 21.73 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.221 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . 0.402 ' HB2' ' O ' ' A' ' 64' ' ' LYS . 56.3 m 68.25 -49.62 0.55 Allowed 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 112.361 0.504 . . . . 0.0 112.361 179.499 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.425 ' ND2' ' HB2' ' A' ' 64' ' ' LYS . 10.3 p30 -32.53 98.18 0.12 Allowed Pre-proline 0 N--CA 1.469 0.522 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 -179.728 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -83.72 -101.73 0.0 OUTLIER 'Trans proline' 0 CA--C 1.536 0.598 0 C-N-CA 122.708 2.272 . . . . 0.0 112.348 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.402 ' CE1' ' HA2' ' A' ' 74' ' ' GLY . 1.8 t-80 175.47 132.08 0.15 Allowed Pre-proline 0 CA--C 1.531 0.228 0 O-C-N 122.343 -0.223 . . . . 0.0 110.875 179.836 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_exo -59.97 155.22 45.62 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.511 2.141 . . . . 0.0 112.41 179.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.412 ' HB2' ' CB ' ' A' ' 35' ' ' SER . 0.0 OUTLIER -97.5 -34.31 11.05 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.754 179.609 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -51.69 -62.04 1.88 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.904 0.383 . . . . 0.0 110.725 179.725 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.428 ' HB3' ' HD2' ' A' ' 73' ' ' PRO . 3.2 mmp_? -63.16 163.81 16.26 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.655 179.695 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.428 ' HD2' ' HB3' ' A' ' 72' ' ' ARG . 87.7 Cg_exo -44.24 -51.96 6.24 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.577 2.185 . . . . 0.0 112.541 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . 0.402 ' HA2' ' CE1' ' A' ' 68' ' ' HIS . . . . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.308 -1.273 . . . . 0.0 112.622 179.762 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 181' ' ' TYR . . . . . 0.44 ' O ' ' N ' ' B' ' 183' ' ' GLY . 0.4 OUTLIER . . . . . 0 N--CA 1.486 1.374 0 CA-C-O 120.705 0.288 . . . . 0.0 111.132 . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 182' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 44.23 -90.11 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.446 -179.925 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 183' ' ' GLY . . . . . 0.44 ' N ' ' O ' ' B' ' 181' ' ' TYR . . . 84.71 11.76 76.44 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.626 -0.797 . . . . 0.0 112.8 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 184' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -67.02 -168.24 0.07 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.75 0.309 . . . . 0.0 110.766 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 185' ' ' LYS . . . . . . . . . . . . . 21.5 tptp -71.68 151.5 43.6 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.983 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 186' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -149.81 -163.87 1.89 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.592 179.896 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 187' ' ' TRP . . . . . 0.433 ' HB2' ' CE2' ' B' ' 190' ' ' TYR . 33.3 p90 -48.45 161.98 0.11 Allowed 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.771 0.32 . . . . 0.0 110.998 179.913 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 188' ' ' VAL . . . . . 0.476 ' HB ' ' H ' ' B' ' 189' ' ' TYR . 0.2 OUTLIER -85.18 -94.03 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.137 -179.717 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 189' ' ' TYR . . . . . 0.476 ' H ' ' HB ' ' B' ' 188' ' ' VAL . 0.4 OUTLIER -160.67 113.48 2.0 Favored 'General case' 0 N--CA 1.455 -0.199 0 O-C-N 122.161 -0.337 . . . . 0.0 111.113 -179.787 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 190' ' ' TYR . . . . . 0.433 ' CE2' ' HB2' ' B' ' 187' ' ' TRP . 1.2 m-85 -120.19 85.21 2.35 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.903 0.382 . . . . 0.0 110.769 179.606 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 191' ' ' THR . . . . . . . . . . . . . 21.7 p -90.38 -10.63 43.23 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.327 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 192' ' ' CYS . . . . . 0.698 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.0 OUTLIER -46.26 172.49 0.01 OUTLIER 'General case' 0 CA--C 1.499 -1.009 0 CA-C-O 121.629 0.728 . . . . 0.0 111.559 -179.957 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 193' ' ' CYS . . . . . 0.698 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.0 OUTLIER 46.96 112.95 0.0 OUTLIER Pre-proline 0 C--N 1.315 -0.933 0 CA-C-N 113.552 -1.658 . . . . 0.0 112.512 173.636 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 194' ' ' PRO . . . . . . . . . . . . . 80.3 Cg_exo -42.22 162.88 0.04 OUTLIER 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.709 2.273 . . . . 0.0 112.622 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -94.34 -15.23 24.58 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.792 -179.45 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 196' ' ' THR . . . . . 0.58 ' C ' ' H ' ' B' ' 198' ' ' TYR . 27.3 p -122.02 40.3 0.44 Allowed Pre-proline 0 C--N 1.331 -0.235 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 197' ' ' PRO . . . . . 0.544 ' CD ' ' N ' ' B' ' 196' ' ' THR . 94.2 Cg_endo -76.25 15.39 0.99 Allowed 'Trans proline' 0 N--CA 1.458 -0.59 0 C-N-CA 121.757 1.638 . . . . 0.0 108.906 176.123 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 198' ' ' TYR . . . . . 0.58 ' H ' ' C ' ' B' ' 196' ' ' THR . 46.5 t80 . . . . . 0 C--O 1.249 1.066 0 CA-C-N 113.947 -1.479 . . . . 0.0 111.338 -178.811 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 27.4 mm . . . . . 0 N--CA 1.486 1.352 0 CA-C-O 120.761 0.315 . . . . 0.0 111.026 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . 0.488 HG21 ' CB ' ' A' ' 15' ' ' THR . 8.2 p -176.9 150.02 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.876 -179.908 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.483 ' C ' ' CG ' ' A' ' 4' ' ' HIS . 3.8 p -111.99 -28.12 8.15 Favored 'General case' 0 C--O 1.224 -0.252 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 -179.193 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . 0.483 ' CG ' ' C ' ' A' ' 3' ' ' CYS . 0.0 OUTLIER 57.67 162.27 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.892 0.377 . . . . 0.0 110.682 -179.495 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.462 ' O ' ' HB ' ' A' ' 11' ' ' ILE . 1.4 m -96.4 35.93 1.42 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.485 -179.641 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.476 ' HB ' ' HB2' ' A' ' 66' ' ' ASN . 24.0 m -37.75 -34.5 0.11 Allowed 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.135 -179.919 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.452 ' CB ' HG13 ' A' ' 11' ' ' ILE . . . 34.79 80.66 0.02 OUTLIER 'General case' 0 N--CA 1.461 0.084 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.316 179.745 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.442 HG23 ' OG1' ' B' ' 191' ' ' THR . 1.9 p 80.15 -44.48 0.27 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.749 -0.659 . . . . 0.0 111.236 -179.546 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.445 ' CB ' ' HD3' ' A' ' 10' ' ' PRO . 0.0 OUTLIER -171.98 -68.4 0.0 OUTLIER Pre-proline 0 CA--C 1.535 0.374 0 N-CA-C 112.572 0.582 . . . . 0.0 112.572 179.741 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.451 ' HB2' ' H ' ' A' ' 11' ' ' ILE . 30.3 Cg_endo -84.11 -132.39 0.01 OUTLIER 'Trans proline' 0 CA--C 1.54 0.796 0 C-N-CA 122.333 2.022 . . . . 0.0 113.335 -178.744 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.462 ' HB ' ' O ' ' A' ' 5' ' ' THR . 24.5 mm 82.12 -110.38 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.511 0 C-N-CA 122.941 0.496 . . . . 0.0 111.699 -179.687 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.2 m -161.96 -162.68 0.87 Allowed 'General case' 0 CA--C 1.53 0.183 0 O-C-N 121.978 -0.451 . . . . 0.0 111.609 -179.425 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -119.04 108.59 14.91 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.696 -179.52 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.417 ' O ' ' OG1' ' A' ' 15' ' ' THR . 0.2 OUTLIER -74.49 -56.51 8.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.165 179.568 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.488 ' CB ' HG21 ' A' ' 2' ' ' VAL . 5.5 p 66.58 128.42 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.389 -178.848 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.471 ' C ' ' CD ' ' A' ' 18' ' ' PRO . 1.7 m -130.13 68.65 81.29 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.098 -179.87 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.56 ' N ' ' CD ' ' A' ' 18' ' ' PRO . 61.6 Cg_endo -102.17 24.03 0.14 Allowed 'Trans proline' 0 CA--C 1.541 0.839 0 C-N-CA 123.417 2.745 . . . . 0.0 115.284 -178.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.56 ' CD ' ' N ' ' A' ' 17' ' ' PRO . 89.2 Cg_endo -82.96 -168.39 0.58 Allowed 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 121.659 1.572 . . . . 0.0 112.111 179.807 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -65.03 79.4 0.07 OUTLIER Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.55 -0.834 . . . . 0.0 111.967 179.669 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 66.42 118.08 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.903 0.382 . . . . 0.0 110.436 -179.47 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.466 ' O ' ' HB2' ' A' ' 22' ' ' LEU . 1.7 t-20 -146.05 -63.21 0.32 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.668 -179.735 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.516 ' HG ' ' HB2' ' A' ' 48' ' ' CYS . 2.4 mm? 70.7 108.72 0.06 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.276 179.586 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.567 ' HA ' ' HA ' ' A' ' 44' ' ' CYS . 5.5 m -64.08 65.34 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 115.901 -0.591 . . . . 0.0 111.639 -179.784 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.466 ' CG ' ' CB ' ' A' ' 45' ' ' ALA . 0.1 OUTLIER -22.72 138.1 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 123.54 0.736 . . . . 0.0 112.639 179.985 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.454 ' HA ' ' HG ' ' A' ' 42' ' ' LEU . 0.2 OUTLIER -128.29 110.38 12.33 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.536 -179.683 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.403 ' HB3' ' CG1' ' A' ' 57' ' ' VAL . 1.5 ptpt -114.14 114.28 25.84 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.298 179.265 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -137.49 97.59 3.5 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.975 0.417 . . . . 0.0 111.272 -179.656 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' TRP . . . . . 0.456 ' CB ' HG22 ' A' ' 39' ' ' VAL . 0.0 OUTLIER -70.21 -165.8 0.11 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.741 179.453 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . 0.426 ' HB3' ' HA ' ' A' ' 33' ' ' CYS . 0.0 OUTLIER -132.22 -167.53 1.9 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.863 -179.249 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -90.31 -49.64 6.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.174 -179.816 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -155.5 -75.31 0.1 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.382 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.406 ' O ' ' CD2' ' A' ' 32' ' ' PHE . 33.7 t80 -90.44 14.08 13.94 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.42 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.426 ' HA ' ' HB3' ' A' ' 29' ' ' CYS . 93.9 m 48.84 79.67 0.07 Allowed 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.771 0.32 . . . . 0.0 111.088 -179.899 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 5.6 p -135.16 42.7 2.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.041 -179.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 60.84 35.22 19.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.014 179.831 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -129.76 31.08 4.79 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.871 179.889 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -104.81 -168.7 24.34 Favored Glycine 0 C--N 1.331 0.266 0 C-N-CA 120.83 -0.7 . . . . 0.0 112.643 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.87 27.85 0.18 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.737 0.303 . . . . 0.0 111.048 -179.89 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.456 HG22 ' CB ' ' A' ' 28' ' ' TRP . 23.6 t -78.01 132.24 32.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.664 179.675 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.5 t -137.0 145.68 29.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.66 -178.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -176.86 -98.98 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.035 179.53 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.454 ' HG ' ' HA ' ' A' ' 25' ' ' ARG . 3.0 mp 57.46 157.6 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 120.623 0.249 . . . . 0.0 111.137 179.928 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 145.99 53.78 0.02 OUTLIER Glycine 0 C--N 1.335 0.518 0 C-N-CA 120.0 -1.095 . . . . 0.0 114.407 179.246 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.567 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 0.0 OUTLIER 57.32 157.87 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 117.373 0.587 . . . . 0.0 112.327 178.612 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.466 ' CB ' ' CG ' ' A' ' 24' ' ' TYR . . . -151.11 -39.27 0.12 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.465 -0.788 . . . . 0.0 111.466 -179.718 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.428 ' HA ' ' HA ' ' A' ' 21' ' ' ASN . . . 80.85 40.52 0.06 Allowed 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.975 -179.766 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 4.6 t -165.77 77.48 0.26 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.67 179.786 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.527 ' N ' ' HD2' ' A' ' 49' ' ' PRO . 52.9 t -69.07 -48.88 26.74 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.417 -179.737 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.527 ' HD2' ' N ' ' A' ' 48' ' ' CYS . 52.0 Cg_endo -69.89 58.95 1.66 Allowed 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 121.705 1.603 . . . . 0.0 110.04 178.628 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 42.8 t -110.0 -109.01 0.34 Allowed 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 114.977 -1.01 . . . . 0.0 111.057 -178.159 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 36.17 77.54 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.323 0 N-CA-C 112.149 0.425 . . . . 0.0 112.149 179.808 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.565 ' HB2' ' HD3' ' A' ' 53' ' ' PRO . 0.0 OUTLIER -104.26 -56.4 0.09 OUTLIER Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.611 179.366 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . 0.565 ' HD3' ' HB2' ' A' ' 52' ' ' LYS . 11.8 Cg_endo -93.29 171.23 2.07 Favored 'Trans proline' 0 N--CA 1.453 -0.908 0 C-N-CA 123.167 2.578 . . . . 0.0 111.749 179.69 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -73.04 71.16 1.09 Allowed 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 120.842 0.353 . . . . 0.0 110.722 179.8 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -105.76 -150.57 0.44 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.289 -179.741 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.1 pm0 -140.18 15.84 2.43 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.216 -179.617 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.442 ' HB ' ' CE2' ' A' ' 24' ' ' TYR . 30.1 m -93.34 137.64 22.09 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-O 120.919 0.39 . . . . 0.0 111.385 -179.843 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 89.0 m -156.41 127.31 6.85 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.013 -179.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . 0.404 ' CB ' ' HG ' ' A' ' 22' ' ' LEU . 0.6 OUTLIER -43.44 133.75 4.2 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.89 179.773 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.554 ' HB2' ' O ' ' A' ' 23' ' ' CYS . 0.5 OUTLIER -114.97 -94.58 0.47 Allowed 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.905 -178.846 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.472 ' HB2' ' HA ' ' A' ' 22' ' ' LEU . 2.3 t 64.07 -76.48 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.79 0.329 . . . . 0.0 111.567 -179.848 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 9.3 t -44.22 134.05 5.07 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.135 -0.484 . . . . 0.0 112.044 -179.054 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 56.17 173.15 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.718 -0.673 . . . . 0.0 111.586 179.384 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.75 84.75 0.11 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.039 179.605 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -93.37 16.96 12.15 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.074 -0.512 . . . . 0.0 112.311 -178.705 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.481 ' ND2' ' O ' ' A' ' 3' ' ' CYS . 0.7 OUTLIER -54.04 163.16 1.25 Allowed Pre-proline 0 N--CA 1.465 0.275 0 CA-C-O 120.908 0.385 . . . . 0.0 111.15 179.841 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_exo -51.25 124.89 15.04 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.709 2.273 . . . . 0.0 112.307 179.78 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 11.8 m-70 -133.75 99.78 13.83 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.856 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -48.81 165.66 0.17 Allowed 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.571 2.181 . . . . 0.0 112.46 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.8 ptmt -114.83 -30.1 6.54 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.976 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.44 ' O ' ' N ' ' A' ' 73' ' ' PRO . 7.4 pt20 -60.39 -16.49 36.1 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.37 179.866 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.67 ' CB ' ' CD ' ' A' ' 73' ' ' PRO . 20.1 mtm180 28.96 -87.09 0.0 OUTLIER Pre-proline 0 CA--C 1.54 0.56 0 C-N-CA 123.183 0.593 . . . . 0.0 112.463 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.67 ' CD ' ' CB ' ' A' ' 72' ' ' ARG . 28.7 Cg_endo -62.2 -178.17 0.33 Allowed 'Trans proline' 0 C--N 1.354 0.846 0 C-N-CA 121.634 1.556 . . . . 0.0 111.915 179.582 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.353 -1.248 . . . . 0.0 112.399 -179.97 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 181' ' ' TYR . . . . . . . . . . . . . 1.7 p90 . . . . . 0 N--CA 1.488 1.466 0 N-CA-C 111.676 0.25 . . . . 0.0 111.676 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 182' ' ' ARG . . . . . . . . . . . . . 8.8 mmm-85 -108.3 63.49 0.61 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.895 0.379 . . . . 0.0 110.811 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 183' ' ' GLY . . . . . . . . . . . . . . . -59.33 113.21 4.94 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.388 -179.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 184' ' ' TRP . . . . . . . . . . . . . 39.8 p90 -59.22 133.57 56.21 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.85 0.357 . . . . 0.0 110.942 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 185' ' ' LYS . . . . . . . . . . . . . 45.8 tttp -58.61 131.0 49.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.905 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 186' ' ' HIS . . . . . . . . . . . . . 96.2 m-70 -84.08 99.7 10.63 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.905 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 187' ' ' TRP . . . . . 0.451 ' HB2' ' CE1' ' B' ' 189' ' ' TYR . 0.6 OUTLIER -49.96 158.24 0.53 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.365 -179.955 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 2.0 p -94.37 -21.24 5.89 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.467 -179.588 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 189' ' ' TYR . . . . . 0.455 ' O ' ' CD2' ' B' ' 189' ' ' TYR . 35.1 p90 -79.47 73.18 6.13 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.828 0.347 . . . . 0.0 111.397 -179.345 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 190' ' ' TYR . . . . . 0.413 ' O ' ' C ' ' B' ' 191' ' ' THR . 0.0 OUTLIER -160.6 123.06 3.23 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.194 179.923 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 191' ' ' THR . . . . . 0.442 ' OG1' HG23 ' A' ' 8' ' ' THR . 0.1 OUTLIER -31.23 144.94 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.597 179.523 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 192' ' ' CYS . . . . . 0.705 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.1 OUTLIER -55.71 -60.8 2.94 Favored 'General case' 0 CA--C 1.5 -0.944 0 CA-C-O 121.506 0.67 . . . . 0.0 112.149 -179.253 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 193' ' ' CYS . . . . . 0.705 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.0 OUTLIER -162.45 163.37 18.36 Favored Pre-proline 0 N--CA 1.436 -1.161 0 CA-C-N 114.278 -1.328 . . . . 0.0 111.752 -173.46 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 194' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -82.74 130.99 6.07 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.768 2.312 . . . . 0.0 112.051 179.604 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 195' ' ' ASP . . . . . 0.445 ' HB3' ' OG ' ' A' ' 9' ' ' SER . 8.1 p-10 -63.84 80.81 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.02 -179.908 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 196' ' ' THR . . . . . 0.687 ' N ' ' CD ' ' B' ' 197' ' ' PRO . 0.7 OUTLIER -118.34 5.43 0.08 OUTLIER Pre-proline 0 C--N 1.328 -0.328 0 N-CA-C 113.763 1.023 . . . . 0.0 113.763 -179.636 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 197' ' ' PRO . . . . . 0.687 ' CD ' ' N ' ' B' ' 196' ' ' THR . 73.9 Cg_endo -74.04 21.93 0.37 Allowed 'Trans proline' 0 C--N 1.354 0.827 0 CA-C-N 120.53 1.225 . . . . 0.0 109.042 176.471 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 198' ' ' TYR . . . . . 0.653 ' H ' ' C ' ' B' ' 196' ' ' THR . 0.2 OUTLIER . . . . . 0 C--O 1.25 1.081 0 CA-C-N 114.058 -1.428 . . . . 0.0 111.379 -178.753 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . 0.444 HG23 HD12 ' A' ' 1' ' ' ILE . 0.1 OUTLIER . . . . . 0 N--CA 1.485 1.313 0 CA-C-O 120.94 0.4 . . . . 0.0 111.132 . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . 0.422 ' CG1' ' HB ' ' A' ' 15' ' ' THR . 3.7 m -98.98 -171.02 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.735 179.751 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -148.14 88.33 1.65 Allowed 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 111.773 0.286 . . . . 0.0 111.773 -179.667 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . 0.566 ' HA ' ' HB ' ' A' ' 14' ' ' VAL . 4.9 p-80 -59.0 126.79 29.17 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.888 0.375 . . . . 0.0 110.23 179.299 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.449 ' CG2' ' CB ' ' A' ' 12' ' ' SER . 75.0 p -47.21 -74.7 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.483 -179.395 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 63.8 p 50.45 23.82 1.39 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.928 179.656 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -120.38 -161.12 0.86 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.564 -0.289 . . . . 0.0 110.327 179.436 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 1.3 t -49.01 96.81 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.146 0 CA-C-O 120.869 0.366 . . . . 0.0 110.066 179.45 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 1.6 m 69.63 77.66 0.23 Allowed Pre-proline 0 C--N 1.331 -0.235 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 -178.532 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.493 ' O ' HG22 ' A' ' 11' ' ' ILE . 29.7 Cg_endo -85.37 -135.38 0.02 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.403 0 C-N-CA 122.95 2.433 . . . . 0.0 112.034 -179.035 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.493 HG22 ' O ' ' A' ' 10' ' ' PRO . 1.1 tt 67.71 4.95 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.182 0 N-CA-C 112.579 0.585 . . . . 0.0 112.579 179.529 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.449 ' CB ' ' CG2' ' A' ' 5' ' ' THR . 0.2 OUTLIER -76.06 -166.85 0.65 Allowed 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 120.967 0.413 . . . . 0.0 111.649 -178.888 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -83.14 92.43 7.43 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.851 -0.613 . . . . 0.0 112.019 -179.217 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.566 ' HB ' ' HA ' ' A' ' 4' ' ' HIS . 2.2 p -57.79 99.95 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.454 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.295 178.854 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.422 ' HB ' ' CG1' ' A' ' 2' ' ' VAL . 0.0 OUTLIER 169.67 116.83 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.831 0.348 . . . . 0.0 111.353 -179.446 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 30.1 t -114.17 137.77 22.63 Favored Pre-proline 0 C--N 1.332 -0.195 0 CA-C-N 116.278 -0.419 . . . . 0.0 109.963 178.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_exo -38.76 103.67 0.04 OUTLIER 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 122.901 2.401 . . . . 0.0 113.018 -179.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_exo -57.17 -160.25 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.724 2.283 . . . . 0.0 112.475 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 64.17 -86.67 0.07 OUTLIER Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.675 -0.774 . . . . 0.0 112.137 -179.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -105.07 142.32 35.06 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 110.252 -0.277 . . . . 0.0 110.252 179.53 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.419 ' HB3' ' N ' ' A' ' 45' ' ' ALA . 1.5 m-20 64.14 88.86 0.1 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.437 -179.617 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.45 ' HG ' ' CB ' ' A' ' 61' ' ' SER . 0.6 OUTLIER -73.66 -80.32 0.07 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.478 -179.49 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 8.4 m -158.52 29.04 0.23 Allowed 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 120.602 0.239 . . . . 0.0 111.546 -178.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.469 ' CG ' ' N ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -83.49 161.93 21.09 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.075 0.464 . . . . 0.0 111.728 -178.973 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.521 ' CB ' ' HA ' ' A' ' 42' ' ' LEU . 0.9 OUTLIER -168.73 -79.08 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 115.718 -0.673 . . . . 0.0 110.973 178.889 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 177.7 165.97 0.66 Allowed 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.646 0.26 . . . . 0.0 110.767 179.844 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' MET . . . . . 0.402 ' O ' ' CG ' ' A' ' 56' ' ' GLU . 0.0 OUTLIER -152.09 -167.18 2.69 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.143 -179.918 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' TRP . . . . . 0.409 ' HA ' ' CE3' ' A' ' 28' ' ' TRP . 2.5 t-105 -148.38 179.02 8.1 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.447 179.756 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -173.59 99.32 0.11 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.837 0.351 . . . . 0.0 111.117 -179.901 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 50.2 t0 -66.05 137.51 57.13 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.555 179.728 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . 59.22 -156.29 0.34 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.524 -179.751 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 14.1 m-85 -82.59 53.11 2.25 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.823 0.344 . . . . 0.0 110.904 179.785 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 56.9 m 44.95 30.06 0.53 Allowed 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.308 -179.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 92.3 p -82.24 -31.67 30.09 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.62 179.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -130.15 114.67 16.01 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.621 179.78 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 33.1 mmm-85 -57.12 133.89 55.39 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.229 -179.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.417 ' O ' ' N ' ' A' ' 39' ' ' VAL . . . -113.65 44.71 1.44 Allowed Glycine 0 C--N 1.33 0.248 0 C-N-CA 120.824 -0.703 . . . . 0.0 112.586 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.415 ' O ' ' HG3' ' A' ' 70' ' ' LYS . 0.2 OUTLIER 58.36 -80.74 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 122.218 0.207 . . . . 0.0 111.402 179.767 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.577 ' O ' ' CG2' ' A' ' 40' ' ' VAL . 3.1 p 35.92 -145.71 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 CA-C-O 119.342 -0.361 . . . . 0.0 111.557 -179.829 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.577 ' CG2' ' O ' ' A' ' 39' ' ' VAL . 1.5 m 91.23 151.46 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 C-N-CA 123.482 0.713 . . . . 0.0 111.455 -179.641 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 167.15 137.6 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.111 -179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.521 ' HA ' ' CB ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -142.28 153.4 43.88 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.03 0.443 . . . . 0.0 111.301 -179.775 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.411 ' N ' ' HB2' ' A' ' 25' ' ' ARG . . . -159.78 12.23 0.18 Allowed Glycine 0 N--CA 1.45 -0.388 0 CA-C-N 115.833 -0.622 . . . . 0.0 112.736 179.782 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 3.3 m 62.65 147.62 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.897 0.38 . . . . 0.0 111.333 179.249 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.419 ' N ' ' HB3' ' A' ' 21' ' ' ASN . . . 175.97 137.3 0.05 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.769 179.345 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -70.27 67.96 0.33 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.051 0.453 . . . . 0.0 110.795 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.438 HG21 ' N ' ' A' ' 48' ' ' CYS . 89.0 m -164.77 147.09 8.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.817 -179.62 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.438 ' N ' HG21 ' A' ' 47' ' ' THR . 0.1 OUTLIER -131.6 67.3 79.79 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.899 179.928 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.545 ' HA ' ' HG3' ' A' ' 52' ' ' LYS . 32.6 Cg_exo -60.94 -11.22 17.22 Favored 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 122.466 2.111 . . . . 0.0 111.659 178.943 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 32.4 t -39.33 -68.7 0.15 Allowed 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 115.598 -0.728 . . . . 0.0 112.336 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 16.6 ptmt -90.69 77.16 6.37 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 120.923 0.392 . . . . 0.0 111.718 -179.238 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.599 ' HB3' ' CD ' ' A' ' 53' ' ' PRO . 0.6 OUTLIER -148.34 -167.11 0.15 Allowed Pre-proline 0 CA--C 1.538 0.494 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 179.682 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . 0.599 ' CD ' ' HB3' ' A' ' 52' ' ' LYS . 76.0 Cg_exo -51.96 -142.33 0.0 OUTLIER 'Trans proline' 0 C--N 1.356 0.947 0 C-N-CA 122.445 2.097 . . . . 0.0 113.198 -179.461 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -75.71 106.97 7.56 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 120.83 0.347 . . . . 0.0 111.782 -179.059 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -144.19 -157.91 0.83 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.585 179.104 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.402 ' CG ' ' O ' ' A' ' 27' ' ' MET . 0.3 OUTLIER -161.25 26.82 0.13 Allowed 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.432 -179.985 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.412 HG13 ' CE2' ' A' ' 24' ' ' TYR . 1.9 t -107.54 170.78 2.41 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.5 179.438 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 10.7 p -148.22 40.54 0.95 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.14 179.718 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . 0.565 ' O ' ' CB ' ' A' ' 60' ' ' CYS . 80.4 m 56.06 -116.51 1.02 Allowed 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.802 -179.316 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.565 ' CB ' ' O ' ' A' ' 59' ' ' CYS . 2.4 m 139.17 47.07 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.476 0.71 . . . . 0.0 109.889 179.401 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.45 ' CB ' ' HG ' ' A' ' 22' ' ' LEU . 79.3 p -115.73 160.55 19.94 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.334 -179.424 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 1.3 m 73.84 17.68 3.51 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.934 -0.576 . . . . 0.0 111.635 179.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.9 p30 171.18 167.93 0.08 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 120.687 0.28 . . . . 0.0 110.909 179.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.481 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 0.0 OUTLIER -56.96 -32.79 66.39 Favored 'General case' 0 CA--C 1.516 -0.352 0 CA-C-O 121.498 0.666 . . . . 0.0 110.913 179.827 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 43.6 t 72.32 -44.36 0.59 Allowed 'General case' 0 C--N 1.313 -0.986 0 CA-C-N 114.727 -1.124 . . . . 0.0 112.689 179.03 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.452 ' HB2' ' NE2' ' A' ' 4' ' ' HIS . 0.3 OUTLIER -40.07 97.35 0.13 Allowed Pre-proline 0 N--CA 1.47 0.543 0 CA-C-O 120.697 0.284 . . . . 0.0 111.532 -178.92 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . 0.459 ' O ' ' CG ' ' A' ' 68' ' ' HIS . 6.7 Cg_exo -73.88 -2.24 11.96 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.953 2.435 . . . . 0.0 112.711 -179.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.459 ' CG ' ' O ' ' A' ' 67' ' ' PRO . 3.4 p80 55.98 168.49 0.05 OUTLIER Pre-proline 0 CA--C 1.53 0.202 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.085 -179.824 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 77.2 Cg_exo -50.53 114.42 1.45 Allowed 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.531 2.154 . . . . 0.0 112.325 -179.869 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.447 ' O ' ' N ' ' A' ' 72' ' ' ARG . 2.3 mtmm -61.52 -61.68 2.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.948 -179.925 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.412 ' HA ' ' CD ' ' A' ' 38' ' ' LYS . 1.3 tt0 52.37 -85.72 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.349 179.745 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.447 ' N ' ' O ' ' A' ' 70' ' ' LYS . 2.1 mmp_? -57.54 154.31 25.17 Favored Pre-proline 0 C--N 1.331 -0.212 0 CA-C-O 120.645 0.259 . . . . 0.0 110.781 179.825 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -59.1 -24.1 72.09 Favored 'Trans proline' 0 C--N 1.343 0.289 0 C-N-CA 122.594 2.196 . . . . 0.0 112.132 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.386 -1.23 . . . . 0.0 112.463 179.896 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 181' ' ' TYR . . . . . . . . . . . . . 47.0 m-85 . . . . . 0 N--CA 1.486 1.341 0 CA-C-O 120.844 0.354 . . . . 0.0 111.197 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 182' ' ' ARG . . . . . . . . . . . . . 8.3 ttt85 62.62 148.0 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.929 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 183' ' ' GLY . . . . . 0.463 ' O ' ' CG ' ' B' ' 184' ' ' TRP . . . -79.43 -18.22 74.22 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.636 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 184' ' ' TRP . . . . . 0.463 ' CG ' ' O ' ' B' ' 183' ' ' GLY . 6.6 p90 46.1 -172.97 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 120.848 0.356 . . . . 0.0 111.529 -179.879 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 185' ' ' LYS . . . . . . . . . . . . . 23.9 ttpp -92.73 128.91 38.76 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.051 -179.484 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 186' ' ' HIS . . . . . . . . . . . . . 7.5 p80 -87.79 -172.49 3.88 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.722 179.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 187' ' ' TRP . . . . . . . . . . . . . 9.5 m95 -90.16 155.04 19.31 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.009 0.433 . . . . 0.0 111.27 -179.75 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 188' ' ' VAL . . . . . 0.475 ' HB ' ' CE1' ' B' ' 190' ' ' TYR . 0.2 OUTLIER -86.97 -152.57 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.161 179.488 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 189' ' ' TYR . . . . . 0.527 ' HB2' HG23 ' A' ' 39' ' ' VAL . 35.9 m-85 -97.55 31.71 2.49 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 120.93 0.395 . . . . 0.0 110.232 179.549 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 190' ' ' TYR . . . . . 0.475 ' CE1' ' HB ' ' B' ' 188' ' ' VAL . 3.7 m-30 -79.48 112.19 16.48 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.919 -179.641 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 191' ' ' THR . . . . . . . . . . . . . 86.4 m -74.98 113.73 12.63 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.465 179.55 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 192' ' ' CYS . . . . . 0.687 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.0 OUTLIER -85.91 170.66 12.13 Favored 'General case' 0 CA--C 1.496 -1.113 0 CA-C-O 121.955 0.883 . . . . 0.0 111.352 -179.8 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 193' ' ' CYS . . . . . 0.687 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.1 OUTLIER 40.02 89.53 0.08 OUTLIER Pre-proline 0 N--CA 1.439 -0.983 0 CA-C-N 113.23 -1.805 . . . . 0.0 112.257 173.774 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 194' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_exo -49.07 176.93 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.61 2.206 . . . . 0.0 112.375 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -65.55 76.27 0.07 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.121 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 196' ' ' THR . . . . . 0.683 ' N ' ' HD3' ' B' ' 197' ' ' PRO . 9.7 t -150.14 45.56 0.36 Allowed Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.934 179.862 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 197' ' ' PRO . . . . . 0.683 ' HD3' ' N ' ' B' ' 196' ' ' THR . 3.7 Cg_exo -76.27 13.55 1.3 Allowed 'Trans proline' 0 C--N 1.351 0.68 0 C-N-CA 121.797 1.665 . . . . 0.0 108.572 175.894 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 198' ' ' TYR . . . . . 0.581 ' H ' ' C ' ' B' ' 196' ' ' THR . 43.6 t80 . . . . . 0 C--O 1.249 1.075 0 CA-C-N 113.766 -1.561 . . . . 0.0 111.237 -178.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 2.8 pp . . . . . 0 N--CA 1.486 1.369 0 CA-C-O 120.789 0.328 . . . . 0.0 111.143 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 22.5 t -144.91 148.46 17.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.55 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -97.31 -156.79 0.55 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.776 179.81 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . 0.496 ' CD2' ' HA ' ' A' ' 64' ' ' LYS . 2.2 p80 -123.89 151.25 43.71 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 178.745 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.673 ' HB ' ' H ' ' A' ' 12' ' ' SER . 42.9 p -60.14 114.17 2.73 Favored 'General case' 0 N--CA 1.439 -0.979 0 CA-C-O 121.554 0.692 . . . . 0.0 111.974 -178.43 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 64.5 m -151.39 27.95 0.65 Allowed 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 114.706 -1.134 . . . . 0.0 108.835 178.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.404 ' CB ' ' CB ' ' A' ' 12' ' ' SER . . . -39.31 -31.7 0.09 Allowed 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 115.346 -0.843 . . . . 0.0 112.357 -179.146 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 88.1 m -125.23 -72.69 0.66 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.78 0.324 . . . . 0.0 111.209 -179.796 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.528 ' CB ' ' CD ' ' A' ' 10' ' ' PRO . 0.4 OUTLIER -146.89 -69.81 0.02 OUTLIER Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.77 179.875 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.528 ' CD ' ' CB ' ' A' ' 9' ' ' SER . 30.5 Cg_endo -63.89 -85.92 0.01 OUTLIER 'Trans proline' 0 C--N 1.348 0.525 0 C-N-CA 121.904 1.736 . . . . 0.0 111.759 179.614 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.445 ' HA ' ' O ' ' A' ' 5' ' ' THR . 0.0 OUTLIER -147.82 149.61 15.22 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.149 0 CA-C-O 120.679 0.275 . . . . 0.0 110.728 179.404 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.673 ' H ' ' HB ' ' A' ' 5' ' ' THR . 0.4 OUTLIER -159.65 -88.15 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 179.936 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.483 ' HA ' ' CG2' ' A' ' 5' ' ' THR . . . -179.97 124.37 0.07 Allowed 'General case' 0 CA--C 1.529 0.148 0 CA-C-O 120.755 0.312 . . . . 0.0 111.624 -179.84 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.437 HG21 ' HA ' ' A' ' 5' ' ' THR . 0.2 OUTLIER -120.3 -99.62 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.089 179.706 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 26.9 p 53.65 173.54 0.02 OUTLIER 'General case' 0 C--O 1.231 0.127 0 CA-C-O 121.076 0.465 . . . . 0.0 111.765 179.697 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.0 t -169.94 135.83 1.28 Allowed Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.151 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_endo -46.25 139.55 12.1 Favored 'Trans proline' 0 C--N 1.348 0.5 0 C-N-CA 122.706 2.271 . . . . 0.0 112.471 -179.717 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_exo -48.78 162.25 0.4 Allowed 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.612 2.208 . . . . 0.0 112.28 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 62.69 124.15 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.621 -0.799 . . . . 0.0 112.175 -179.782 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER 61.33 59.57 1.9 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.107 0.48 . . . . 0.0 110.655 -179.809 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 16.5 p-10 -155.29 96.05 1.77 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.53 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.409 ' O ' ' N ' ' A' ' 61' ' ' SER . 59.2 mt -112.79 28.16 9.02 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.615 -179.493 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.546 ' O ' ' CB ' ' A' ' 60' ' ' CYS . 7.8 t 37.08 67.44 0.35 Allowed 'General case' 0 C--O 1.222 -0.373 0 CA-C-N 116.6 -0.273 . . . . 0.0 111.608 179.331 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.549 ' CG ' ' HB1' ' A' ' 45' ' ' ALA . 0.0 OUTLIER -84.25 170.49 13.66 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 121.204 0.526 . . . . 0.0 112.366 -179.002 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.475 ' HB2' ' O ' ' A' ' 42' ' ' LEU . 0.0 OUTLIER 174.57 150.75 0.09 Allowed 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.477 -179.67 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.584 ' O ' ' CB ' ' A' ' 27' ' ' MET . 0.1 OUTLIER -144.83 -83.48 0.14 Allowed 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 120.765 -0.374 . . . . 0.0 111.821 179.996 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' MET . . . . . 0.584 ' CB ' ' O ' ' A' ' 26' ' ' LYS . 5.7 ptt? 134.09 -144.84 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.989 0.916 . . . . 0.0 108.692 -179.155 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' TRP . . . . . 0.419 ' CD1' ' HG3' ' A' ' 56' ' ' GLU . 0.0 OUTLIER -169.9 170.46 7.71 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-O 120.71 0.29 . . . . 0.0 110.892 179.179 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 18.4 t -177.38 -77.05 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.919 179.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 170.41 -80.76 0.0 OUTLIER 'General case' 0 CA--C 1.529 0.17 0 CA-C-O 120.676 0.274 . . . . 0.0 110.992 179.875 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -161.97 -80.98 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.189 179.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 35.2 p90 -97.5 21.05 10.73 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.777 0.322 . . . . 0.0 111.087 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 2.3 p -75.51 125.28 28.71 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.0 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 5.5 m -62.92 -20.81 65.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.232 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 25.7 p -87.38 50.88 2.09 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.884 0.373 . . . . 0.0 111.013 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 4.6 ptt85 -67.04 81.87 0.12 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.97 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.428 ' O ' ' N ' ' A' ' 39' ' ' VAL . . . 163.31 -142.18 7.68 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.678 -0.773 . . . . 0.0 112.6 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.411 ' HD2' ' CD ' ' A' ' 70' ' ' LYS . 0.0 OUTLIER 65.93 -63.59 0.22 Allowed 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.523 0.202 . . . . 0.0 111.061 -179.745 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.458 ' CG2' ' CG ' ' B' ' 189' ' ' TYR . 2.3 t -54.72 106.97 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 121.079 0.466 . . . . 0.0 110.049 179.521 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.448 HG11 ' HA ' ' B' ' 191' ' ' THR . 0.1 OUTLIER -39.62 155.82 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 N-CA-C 113.265 0.839 . . . . 0.0 113.265 -178.152 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.409 ' HG2' ' HG2' ' A' ' 25' ' ' ARG . 2.0 mp0 -100.32 -164.08 1.08 Allowed 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 114.51 -1.223 . . . . 0.0 111.206 -179.163 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.507 HD13 ' CZ ' ' A' ' 24' ' ' TYR . 2.8 mt -120.52 -163.96 1.06 Allowed 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.659 -179.815 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.459 ' HA2' ' O ' ' A' ' 24' ' ' TYR . . . -160.43 123.97 1.28 Allowed Glycine 0 C--N 1.335 0.482 0 C-N-CA 120.329 -0.939 . . . . 0.0 113.73 -179.104 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.478 ' O ' ' CE1' ' A' ' 24' ' ' TYR . 0.5 OUTLIER 59.59 129.06 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 112.392 0.516 . . . . 0.0 112.392 179.075 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.549 ' HB1' ' CG ' ' A' ' 24' ' ' TYR . . . -140.73 -164.27 1.7 Allowed 'General case' 0 N--CA 1.461 0.103 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.176 179.921 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -132.04 20.32 4.51 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.602 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.5 m -178.58 124.07 0.1 Allowed 'General case' 0 CA--C 1.53 0.194 0 CA-C-O 120.777 0.322 . . . . 0.0 110.89 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.639 ' O ' ' N ' ' A' ' 50' ' ' SER . 47.5 t -77.83 -55.92 1.16 Allowed Pre-proline 0 C--N 1.332 -0.186 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.813 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.52 ' HD2' ' N ' ' A' ' 48' ' ' CYS . 4.0 Cg_exo -40.22 81.76 0.01 OUTLIER 'Trans proline' 0 C--N 1.356 0.967 0 C-N-CA 122.627 2.218 . . . . 0.0 111.411 179.842 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.639 ' N ' ' O ' ' A' ' 48' ' ' CYS . 41.1 t -131.25 8.31 4.68 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.296 -0.865 . . . . 0.0 111.541 -178.083 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 8.9 mtmt -61.93 -19.2 62.46 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.236 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.521 ' HB3' ' HD2' ' A' ' 53' ' ' PRO . 0.0 OUTLIER -57.15 179.64 0.13 Allowed Pre-proline 0 C--N 1.331 -0.227 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.311 179.894 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . 0.521 ' HD2' ' HB3' ' A' ' 52' ' ' LYS . 97.8 Cg_exo -45.14 -45.72 14.3 Favored 'Trans proline' 0 C--N 1.349 0.587 0 C-N-CA 122.353 2.036 . . . . 0.0 112.484 -179.833 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . 0.464 ' CE2' ' HB2' ' A' ' 52' ' ' LYS . 0.0 OUTLIER -69.61 65.47 0.2 Allowed 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 121.065 0.459 . . . . 0.0 110.63 179.705 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -82.16 -145.33 0.06 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.641 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.431 ' O ' ' CG1' ' A' ' 57' ' ' VAL . 15.9 tt0 76.22 20.95 1.52 Allowed 'General case' 0 CA--C 1.524 -0.046 0 CA-C-O 120.546 0.213 . . . . 0.0 110.813 -179.593 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.516 HG12 ' CE2' ' A' ' 24' ' ' TYR . 0.0 OUTLIER 178.72 141.83 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.462 0.167 0 CA-C-O 121.064 0.459 . . . . 0.0 111.503 179.409 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 11.5 t -157.93 140.51 14.63 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.313 179.753 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 31.8 p -45.94 123.57 4.63 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 120.989 0.423 . . . . 0.0 111.381 -179.497 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.546 ' CB ' ' O ' ' A' ' 23' ' ' CYS . 0.1 OUTLIER -131.25 44.55 2.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.423 -179.707 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.409 ' N ' ' O ' ' A' ' 22' ' ' LEU . 8.8 p -80.81 132.2 35.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.355 -179.41 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 1.2 m 177.21 -74.4 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.159 179.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 67.9 t0 179.99 -37.76 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.595 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.496 ' HA ' ' CD2' ' A' ' 4' ' ' HIS . 1.5 mtpt -131.1 79.09 1.87 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.607 179.83 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . 0.467 ' HB3' ' HB3' ' A' ' 60' ' ' CYS . 0.0 OUTLIER -137.98 7.0 2.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.875 -179.718 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.472 ' HB2' ' HD2' ' A' ' 67' ' ' PRO . 0.1 OUTLIER -57.61 166.63 1.68 Allowed Pre-proline 0 N--CA 1.462 0.162 0 CA-C-O 120.493 0.187 . . . . 0.0 110.695 -179.991 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . 0.472 ' HD2' ' HB2' ' A' ' 66' ' ' ASN . 88.6 Cg_exo -44.72 162.96 0.07 OUTLIER 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.409 2.073 . . . . 0.0 112.161 179.688 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -176.24 64.05 0.22 Allowed Pre-proline 0 C--N 1.326 -0.427 0 CA-C-O 120.894 0.378 . . . . 0.0 111.068 -179.605 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . 0.457 ' HG2' ' HB ' ' B' ' 191' ' ' THR . 77.8 Cg_exo -49.57 129.59 23.75 Favored 'Trans proline' 0 C--N 1.344 0.31 0 C-N-CA 122.594 2.196 . . . . 0.0 111.751 179.556 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.503 ' O ' ' C ' ' A' ' 71' ' ' GLN . 0.4 OUTLIER -69.94 -47.25 63.12 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 120.836 -0.346 . . . . 0.0 111.564 -179.231 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.503 ' C ' ' O ' ' A' ' 70' ' ' LYS . 2.2 tt0 19.79 53.53 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 179.743 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.43 ' N ' ' O ' ' A' ' 70' ' ' LYS . 0.1 OUTLIER -79.8 132.63 60.43 Favored Pre-proline 0 C--N 1.33 -0.241 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.014 -179.509 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -77.9 -167.77 0.52 Allowed 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 122.554 2.169 . . . . 0.0 112.418 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.097 0 CA-C-O 118.398 -1.223 . . . . 0.0 112.582 180.0 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 181' ' ' TYR . . . . . . . . . . . . . 10.4 t80 . . . . . 0 N--CA 1.486 1.374 0 CA-C-O 120.859 0.362 . . . . 0.0 111.279 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 182' ' ' ARG . . . . . . . . . . . . . 11.5 tpt180 -57.86 136.56 57.02 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.984 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 183' ' ' GLY . . . . . . . . . . . . . . . -53.21 103.08 0.12 Allowed Glycine 0 CA--C 1.518 0.266 0 C-N-CA 120.847 -0.692 . . . . 0.0 112.708 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 184' ' ' TRP . . . . . . . . . . . . . 21.3 p90 -100.69 151.43 21.66 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.732 0.301 . . . . 0.0 110.893 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 185' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -177.42 141.24 0.3 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.952 179.926 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 186' ' ' HIS . . . . . . . . . . . . . 9.2 p80 -79.94 63.49 4.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.812 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 187' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -57.22 -68.17 0.25 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.013 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 2.3 p -82.67 125.28 39.93 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.314 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.925 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 189' ' ' TYR . . . . . 0.458 ' CG ' ' CG2' ' A' ' 39' ' ' VAL . 0.1 OUTLIER -84.26 133.51 34.56 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.418 179.894 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 190' ' ' TYR . . . . . . . . . . . . . 44.9 t80 -160.04 135.94 8.53 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.294 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 191' ' ' THR . . . . . 0.457 ' HB ' ' HG2' ' A' ' 69' ' ' PRO . 14.5 t -33.12 141.32 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 115.876 -0.602 . . . . 0.0 112.145 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 192' ' ' CYS . . . . . 0.685 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.1 OUTLIER -90.33 169.5 11.05 Favored 'General case' 0 CA--C 1.499 -0.993 0 CA-C-O 122.252 1.025 . . . . 0.0 111.972 -179.759 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 193' ' ' CYS . . . . . 0.685 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.1 OUTLIER 36.27 92.71 0.05 OUTLIER Pre-proline 0 C--N 1.314 -0.955 0 CA-C-N 112.795 -2.002 . . . . 0.0 113.119 173.394 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 194' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -59.27 145.03 99.1 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.592 2.195 . . . . 0.0 112.042 179.549 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 78.6 m-20 -131.35 12.17 5.0 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.515 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 196' ' ' THR . . . . . 0.595 ' C ' ' H ' ' B' ' 198' ' ' TYR . 0.2 OUTLIER -122.26 35.4 0.26 Allowed Pre-proline 0 C--N 1.33 -0.27 0 N-CA-C 112.096 0.406 . . . . 0.0 112.096 179.873 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 197' ' ' PRO . . . . . 0.59 ' CD ' ' N ' ' B' ' 196' ' ' THR . 77.9 Cg_endo -74.73 15.7 0.68 Allowed 'Trans proline' 0 C--N 1.35 0.638 0 C-N-CA 121.551 1.501 . . . . 0.0 108.967 176.203 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 198' ' ' TYR . . . . . 0.595 ' H ' ' C ' ' B' ' 196' ' ' THR . 7.9 t80 . . . . . 0 C--O 1.249 1.028 0 CA-C-N 114.033 -1.44 . . . . 0.0 111.25 -178.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . 0.427 ' O ' ' CG2' ' A' ' 2' ' ' VAL . 5.1 mp . . . . . 0 N--CA 1.485 1.322 0 CA-C-O 120.421 0.153 . . . . 0.0 111.13 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . 0.427 ' CG2' ' O ' ' A' ' 1' ' ' ILE . 33.3 m 45.82 -179.34 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.312 0 CA-C-O 120.897 0.379 . . . . 0.0 111.865 -179.788 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 55.9 m -128.78 -139.76 0.24 Allowed 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.999 -179.165 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . 0.431 ' CE1' ' ND2' ' A' ' 66' ' ' ASN . 0.3 OUTLIER -109.48 -95.77 0.4 Allowed 'General case' 0 CA--C 1.53 0.188 0 O-C-N 122.406 -0.184 . . . . 0.0 110.53 179.926 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.3 t -145.13 145.66 31.48 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.974 0.416 . . . . 0.0 110.916 179.396 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 9.6 p -103.19 77.92 1.58 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.892 -179.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -177.96 -68.67 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.174 -179.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -162.91 147.16 11.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.797 -179.817 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 57.97 174.55 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.959 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -80.17 -88.37 0.0 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.51 0 C-N-CA 122.487 2.125 . . . . 0.0 111.842 179.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.461 ' O ' ' CB ' ' A' ' 12' ' ' SER . 1.2 mp 70.34 -57.72 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.16 0 N-CA-C 112.203 0.446 . . . . 0.0 112.203 179.134 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.461 ' CB ' ' O ' ' A' ' 11' ' ' ILE . 1.2 m 84.58 111.44 0.05 Allowed 'General case' 0 N--CA 1.464 0.225 0 CA-C-O 120.835 0.35 . . . . 0.0 110.511 -179.104 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -163.81 -31.8 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.695 -179.597 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.515 ' CG2' ' H ' ' A' ' 15' ' ' THR . 2.0 m -41.11 -86.59 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.354 0 N-CA-C 111.478 0.177 . . . . 0.0 111.478 -179.727 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.515 ' H ' ' CG2' ' A' ' 14' ' ' VAL . 26.2 p 51.07 104.63 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.904 0.383 . . . . 0.0 111.9 179.423 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.638 ' N ' ' HD3' ' A' ' 17' ' ' PRO . 28.3 p -138.87 49.67 2.36 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.021 178.668 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.638 ' HD3' ' N ' ' A' ' 16' ' ' CYS . 35.6 Cg_exo -60.29 -44.87 25.62 Favored 'Trans proline' 0 C--N 1.353 0.783 0 C-N-CA 122.675 2.25 . . . . 0.0 113.42 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.461 ' HD2' ' N ' ' A' ' 17' ' ' PRO . 37.3 Cg_exo -38.2 -44.08 1.88 Allowed 'Trans proline' 0 C--N 1.349 0.593 0 C-N-CA 122.918 2.412 . . . . 0.0 113.401 -179.259 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -107.93 -136.22 7.89 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.476 -0.868 . . . . 0.0 113.143 -179.692 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.557 ' CB ' ' HA ' ' A' ' 46' ' ' ALA . 0.3 OUTLIER -35.71 -42.94 0.27 Allowed 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 112.937 0.717 . . . . 0.0 112.937 -179.347 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.425 ' N ' ' HG2' ' A' ' 20' ' ' GLU . 0.1 OUTLIER 79.19 -52.52 0.44 Allowed 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 114.845 -1.07 . . . . 0.0 110.926 -179.398 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.758 ' O ' ' HA ' ' A' ' 44' ' ' CYS . 0.4 OUTLIER -59.72 118.25 5.93 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 179.368 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.533 ' HA ' ' HA ' ' A' ' 44' ' ' CYS . 6.0 m -80.44 39.7 0.47 Allowed 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 113.091 0.775 . . . . 0.0 113.091 -178.514 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.51 ' O ' ' HB2' ' A' ' 60' ' ' CYS . 0.1 OUTLIER 43.67 -165.58 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.375 0 CA-C-O 120.71 0.29 . . . . 0.0 111.204 179.55 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.438 ' CB ' HG23 ' A' ' 58' ' ' THR . 0.1 OUTLIER -179.97 90.2 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.979 -0.288 . . . . 0.0 111.615 179.717 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.403 ' HG2' ' CG1' ' A' ' 57' ' ' VAL . 4.8 mtmt -84.09 110.82 18.78 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.796 179.538 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 1.6 ttp -131.03 92.2 3.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.312 -179.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' TRP . . . . . 0.404 ' CZ3' ' O ' ' A' ' 54' ' ' TYR . 0.0 OUTLIER -67.12 -159.81 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.409 179.574 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 93.5 m -148.94 157.54 43.5 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.852 0.358 . . . . 0.0 110.986 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -137.71 121.02 16.97 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.676 179.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.427 ' C ' ' CG ' ' A' ' 32' ' ' PHE . . . 62.22 90.39 0.07 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.814 -179.717 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.427 ' CG ' ' C ' ' A' ' 31' ' ' ALA . 4.6 p90 44.48 30.11 0.46 Allowed 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.361 -179.79 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 9.2 t 43.55 55.75 4.78 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.37 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -156.74 28.38 0.32 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.657 179.803 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.429 ' O ' ' C ' ' A' ' 36' ' ' ARG . 43.2 m -138.24 37.86 2.3 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.585 -179.891 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.429 ' C ' ' O ' ' A' ' 35' ' ' SER . 0.2 OUTLIER 25.84 89.77 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 115.739 -0.664 . . . . 0.0 112.275 179.55 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.414 ' N ' ' HG3' ' A' ' 70' ' ' LYS . . . -80.06 -127.33 0.66 Allowed Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.639 -0.791 . . . . 0.0 113.315 -179.557 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.407 ' O ' ' HB3' ' B' ' 190' ' ' TYR . 0.0 OUTLIER -173.46 99.89 0.12 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.947 0.404 . . . . 0.0 110.211 -179.302 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 58.7 t -155.89 139.94 8.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.578 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.432 HG21 HD23 ' A' ' 42' ' ' LEU . 7.1 p -161.56 159.89 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.869 -179.47 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.499 ' C ' ' HG ' ' A' ' 42' ' ' LEU . 13.9 tp10 -173.32 -58.36 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.379 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.499 ' HG ' ' C ' ' A' ' 41' ' ' GLU . 0.0 OUTLIER 44.12 -168.82 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.861 -179.348 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 141.58 37.64 0.09 OUTLIER Glycine 0 C--N 1.328 0.102 0 C-N-CA 120.157 -1.021 . . . . 0.0 113.678 179.447 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.758 ' HA ' ' O ' ' A' ' 22' ' ' LEU . 59.2 m 61.99 141.26 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.887 0.344 . . . . 0.0 111.348 179.191 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.488 ' N ' ' HG3' ' A' ' 20' ' ' GLU . . . -130.0 -99.57 0.33 Allowed 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 112.042 0.386 . . . . 0.0 112.042 -179.557 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.557 ' HA ' ' CB ' ' A' ' 20' ' ' GLU . . . -179.33 -41.4 0.01 OUTLIER 'General case' 0 C--O 1.23 0.057 0 CA-C-O 120.906 0.384 . . . . 0.0 110.958 -179.368 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 4.7 t -178.12 45.65 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.118 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.461 ' N ' ' HD3' ' A' ' 49' ' ' PRO . 10.1 m 55.68 62.9 6.78 Favored Pre-proline 0 C--N 1.332 -0.195 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.374 179.733 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.461 ' HD3' ' N ' ' A' ' 48' ' ' CYS . 5.4 Cg_exo -76.47 3.9 5.96 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.755 2.303 . . . . 0.0 111.502 178.862 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.482 ' O ' ' HB2' ' A' ' 51' ' ' LYS . 30.3 t -51.05 -62.55 1.55 Allowed 'General case' 0 N--CA 1.455 -0.195 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.519 -179.804 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.482 ' HB2' ' O ' ' A' ' 50' ' ' SER . 9.5 mtpt 77.87 -50.28 0.5 Allowed 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.483 -179.729 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.36 133.16 20.72 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.003 -179.739 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 69.2 Cg_endo -76.16 -47.94 0.15 Allowed 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.534 2.156 . . . . 0.0 112.612 -179.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . 0.404 ' O ' ' CZ3' ' A' ' 28' ' ' TRP . 0.0 OUTLIER -51.94 -25.94 9.32 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.101 -179.911 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -55.56 -85.36 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.94 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 167.33 -74.92 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 120.945 0.402 . . . . 0.0 110.971 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.507 ' HB ' ' CE1' ' A' ' 24' ' ' TYR . 2.8 m -50.54 154.37 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 115.899 -0.592 . . . . 0.0 111.924 -179.615 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.438 HG23 ' CB ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -164.1 -95.25 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.992 179.648 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -151.11 160.15 44.06 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 120.94 0.4 . . . . 0.0 111.315 -179.699 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.51 ' HB2' ' O ' ' A' ' 24' ' ' TYR . 0.1 OUTLIER -138.7 -18.59 1.07 Allowed 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.609 179.846 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 83.1 p -42.8 106.33 0.06 Allowed 'General case' 0 N--CA 1.462 0.17 0 CA-C-O 120.843 0.354 . . . . 0.0 111.859 -179.503 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 4.0 p -164.84 -76.45 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.601 179.646 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . 0.421 ' HA ' HG23 ' A' ' 1' ' ' ILE . 30.6 p-10 177.58 -39.31 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.704 179.821 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.414 ' O ' ' ND2' ' A' ' 66' ' ' ASN . 0.0 OUTLIER -160.81 56.52 0.31 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.998 -0.547 . . . . 0.0 110.486 179.712 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . 0.426 ' O ' ' C ' ' A' ' 66' ' ' ASN . 1.3 p -55.12 -62.73 1.47 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.366 -179.499 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.431 ' ND2' ' CE1' ' A' ' 4' ' ' HIS . 9.2 p30 29.69 62.02 0.86 Allowed Pre-proline 0 N--CA 1.468 0.466 0 C-N-CA 122.625 0.37 . . . . 0.0 111.962 -179.78 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_exo -52.35 -57.21 2.24 Favored 'Trans proline' 0 C--N 1.343 0.274 0 C-N-CA 122.651 2.234 . . . . 0.0 112.8 -179.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.463 ' HB3' ' HD2' ' A' ' 69' ' ' PRO . 15.7 m170 62.34 161.01 0.12 Allowed Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.349 -179.671 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . 0.463 ' HD2' ' HB3' ' A' ' 68' ' ' HIS . 67.7 Cg_exo -36.23 126.07 0.37 Allowed 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 123.046 2.497 . . . . 0.0 112.791 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.414 ' HG3' ' N ' ' A' ' 37' ' ' GLY . 0.0 OUTLIER -57.44 -16.9 10.68 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.288 -179.977 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.51 64.54 0.18 Allowed 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.969 0.414 . . . . 0.0 110.736 179.652 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.704 ' N ' ' HD2' ' A' ' 73' ' ' PRO . 5.3 ptp180 -60.11 -42.5 90.22 Favored Pre-proline 0 CA--C 1.534 0.353 0 N-CA-C 112.423 0.527 . . . . 0.0 112.423 -179.705 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.704 ' HD2' ' N ' ' A' ' 72' ' ' ARG . 5.0 Cg_endo -47.14 -26.89 5.73 Favored 'Trans proline' 0 C--N 1.352 0.721 0 C-N-CA 122.309 2.006 . . . . 0.0 112.513 -179.695 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.387 -1.229 . . . . 0.0 112.445 179.858 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 181' ' ' TYR . . . . . . . . . . . . . 17.8 m-85 . . . . . 0 N--CA 1.486 1.351 0 CA-C-O 120.814 0.34 . . . . 0.0 111.134 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 182' ' ' ARG . . . . . . . . . . . . . 13.6 ttt-85 60.86 156.39 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.912 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 183' ' ' GLY . . . . . . . . . . . . . . . 64.99 72.42 0.72 Allowed Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.406 -179.844 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 184' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -78.69 -2.8 40.95 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.561 0.219 . . . . 0.0 111.409 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 185' ' ' LYS . . . . . . . . . . . . . 3.5 tttp 63.7 137.41 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.115 0 CA-C-O 120.859 0.361 . . . . 0.0 110.957 179.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 186' ' ' HIS . . . . . . . . . . . . . 8.4 t60 -90.11 164.54 14.43 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.754 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 187' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -78.61 -176.36 4.81 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.832 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -80.12 -172.7 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.675 179.712 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 189' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -95.78 56.2 1.71 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.69 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 190' ' ' TYR . . . . . 0.439 ' CZ ' ' HA ' ' B' ' 192' ' ' CYS . 1.2 p90 -108.3 149.46 28.62 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.234 -179.678 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 191' ' ' THR . . . . . 0.454 ' HB ' ' CD ' ' A' ' 69' ' ' PRO . 24.2 m -62.19 86.63 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.022 0.439 . . . . 0.0 110.487 179.502 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 192' ' ' CYS . . . . . 0.7 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.5 OUTLIER -35.95 -54.37 0.76 Allowed 'General case' 0 CA--C 1.501 -0.939 0 CA-C-O 121.965 0.888 . . . . 0.0 112.296 -179.603 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 193' ' ' CYS . . . . . 0.7 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.0 OUTLIER -150.28 107.73 3.17 Favored Pre-proline 0 N--CA 1.434 -1.227 0 CA-C-N 113.492 -1.685 . . . . 0.0 111.903 -173.736 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 194' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -76.36 178.47 7.49 Favored 'Trans proline' 0 C--N 1.348 0.522 0 C-N-CA 122.545 2.163 . . . . 0.0 112.054 179.735 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 4.8 t0 55.06 100.18 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.916 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 196' ' ' THR . . . . . 0.719 ' N ' ' HD3' ' B' ' 197' ' ' PRO . 1.8 t -112.08 20.57 0.07 OUTLIER Pre-proline 0 CA--C 1.533 0.293 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 -179.783 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 197' ' ' PRO . . . . . 0.719 ' HD3' ' N ' ' B' ' 196' ' ' THR . 6.6 Cg_exo -68.52 19.43 0.14 Allowed 'Trans proline' 0 C--N 1.358 1.068 0 CA-C-N 120.382 1.172 . . . . 0.0 109.6 176.302 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 198' ' ' TYR . . . . . 0.68 ' H ' ' C ' ' B' ' 196' ' ' THR . 64.9 t80 . . . . . 0 C--O 1.249 1.046 0 CA-C-N 114.535 -1.211 . . . . 0.0 111.248 -178.828 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . 0.414 ' CG2' ' HB2' ' A' ' 63' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.445 0 CA-C-O 120.827 0.346 . . . . 0.0 110.989 . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . 0.449 ' O ' ' HB3' ' A' ' 63' ' ' ASP . 48.9 t -125.7 133.27 69.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.796 179.629 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.517 ' O ' ' C ' ' A' ' 4' ' ' HIS . 19.4 m -92.33 65.22 4.53 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -178.545 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . 0.517 ' C ' ' O ' ' A' ' 3' ' ' CYS . 0.5 OUTLIER -10.49 93.03 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 112.651 0.611 . . . . 0.0 112.651 179.596 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.422 ' O ' ' O ' ' A' ' 4' ' ' HIS . 0.0 OUTLIER 39.24 -166.07 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 115.951 -0.568 . . . . 0.0 112.042 179.492 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.46 ' O ' ' CB ' ' A' ' 7' ' ' ALA . 3.9 t -99.25 23.31 9.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.712 179.836 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.46 ' CB ' ' O ' ' A' ' 6' ' ' THR . . . 86.87 -31.3 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.624 -179.847 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.08 -27.76 67.63 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.673 0.273 . . . . 0.0 111.149 -179.824 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 5.7 t -123.36 152.02 63.68 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.916 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_endo -64.41 -48.46 4.51 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.437 2.091 . . . . 0.0 112.33 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 12.9 tt -178.62 144.37 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.158 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 17.6 t -157.58 -81.23 0.06 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.201 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -152.76 57.02 0.8 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.961 0.41 . . . . 0.0 110.761 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.504 ' CG1' ' H ' ' A' ' 15' ' ' THR . 2.8 p -74.81 -107.22 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.083 -179.451 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.504 ' H ' ' CG1' ' A' ' 14' ' ' VAL . 3.3 p 62.26 144.8 0.02 OUTLIER 'General case' 0 CA--C 1.522 -0.118 0 CA-C-O 120.944 0.402 . . . . 0.0 110.895 -179.956 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.483 ' HB3' ' CD ' ' A' ' 17' ' ' PRO . 0.1 OUTLIER -148.02 -65.41 0.02 OUTLIER Pre-proline 0 C--N 1.326 -0.449 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.607 -179.834 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.483 ' CD ' ' HB3' ' A' ' 16' ' ' CYS . 9.2 Cg_endo -52.09 100.1 0.05 OUTLIER 'Trans proline' 0 C--N 1.348 0.545 0 C-N-CA 122.62 2.213 . . . . 0.0 112.861 -179.633 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.427 ' HD3' ' O ' ' A' ' 16' ' ' CYS . 1.9 Cg_endo -82.16 -57.83 0.03 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.55 0 C-N-CA 122.993 2.462 . . . . 0.0 111.451 179.494 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -124.98 -40.81 0.4 Allowed Glycine 0 N--CA 1.45 -0.421 0 CA-C-N 115.836 -0.62 . . . . 0.0 112.009 179.559 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 24.9 tp10 -160.11 68.33 0.38 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.897 0.38 . . . . 0.0 110.83 179.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -140.95 83.51 1.89 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.045 -179.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.469 ' HB3' ' CB ' ' A' ' 61' ' ' SER . 47.2 mt -52.29 151.54 3.9 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.814 0.34 . . . . 0.0 111.11 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.557 ' HA ' ' HA ' ' A' ' 44' ' ' CYS . 5.3 t -78.66 167.91 20.53 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.6 179.845 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.497 ' N ' ' HA ' ' A' ' 44' ' ' CYS . 0.2 OUTLIER -121.49 -176.31 3.27 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-O 120.737 0.303 . . . . 0.0 110.902 179.851 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 4.5 ttm180 -176.28 97.76 0.06 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.254 179.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 2.7 mtpt -80.65 148.23 30.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.298 179.487 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -154.17 98.61 2.16 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.835 0.35 . . . . 0.0 111.605 -179.796 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 1.8 t90 -77.86 -144.68 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.32 179.409 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 38.5 t -176.71 -36.4 0.01 OUTLIER 'General case' 0 C--O 1.231 0.083 0 CA-C-O 120.744 0.307 . . . . 0.0 111.11 -179.814 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 1.6 t70 77.84 -61.46 0.4 Allowed 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.906 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -174.24 96.17 0.09 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.884 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER 58.88 104.62 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.405 -179.627 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -112.41 -83.56 0.59 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.277 -179.645 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 4.1 p 70.09 -60.22 0.49 Allowed 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.765 0.317 . . . . 0.0 110.639 -179.574 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -110.51 -21.77 11.99 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.964 179.794 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.59 -86.19 0.03 OUTLIER 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 116.627 -0.261 . . . . 0.0 110.945 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.403 ' O ' ' C ' ' A' ' 38' ' ' LYS . . . 73.84 -88.48 0.65 Allowed Glycine 0 C--N 1.334 0.455 0 C-N-CA 120.467 -0.873 . . . . 0.0 112.741 179.896 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.437 ' HB3' ' HB2' ' A' ' 70' ' ' LYS . 0.0 OUTLIER 31.54 45.9 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 121.065 0.46 . . . . 0.0 111.872 -179.826 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 5.3 m -140.04 90.68 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.829 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 26.9 m -113.07 162.06 11.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.296 -179.704 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 178.38 35.44 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.199 179.858 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.99 128.88 38.27 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.504 179.794 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -135.67 7.49 4.23 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.427 -0.892 . . . . 0.0 113.376 -179.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.557 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 0.5 OUTLIER 61.44 131.83 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.169 0.509 . . . . 0.0 111.847 179.345 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.457 ' CB ' ' CE1' ' A' ' 24' ' ' TYR . . . -104.29 -171.83 2.0 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.895 179.861 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -120.54 -16.24 8.35 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 112.117 0.414 . . . . 0.0 112.117 -179.716 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 5.1 t -160.76 26.51 0.15 Allowed 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 111.902 0.334 . . . . 0.0 111.902 -179.784 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER 51.6 53.6 13.48 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-O 120.686 0.279 . . . . 0.0 111.06 179.583 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -70.41 58.88 1.91 Allowed 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.285 1.99 . . . . 0.0 110.338 178.606 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 36.3 t -130.12 133.3 46.55 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.474 -0.784 . . . . 0.0 111.024 -178.364 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 175.22 46.08 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.799 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -127.96 164.17 38.73 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.707 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -54.91 -162.97 0.01 OUTLIER 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.725 2.283 . . . . 0.0 112.268 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -46.59 96.27 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.378 -179.863 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -113.67 -82.57 0.6 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.908 179.718 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 177.12 -57.43 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.788 0.328 . . . . 0.0 110.97 179.963 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 27.4 m -65.32 154.96 7.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.353 -179.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 11.6 t -147.45 22.63 1.16 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.906 179.716 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 10.8 m 60.02 110.92 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.179 179.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.478 ' HB3' ' C ' ' A' ' 23' ' ' CYS . 46.9 t -100.29 35.27 2.13 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.422 179.599 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.544 ' O ' ' OG1' ' A' ' 62' ' ' THR . 52.9 p -60.79 80.25 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.117 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.73 -180.0 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' THR . . . . . 0.544 ' OG1' ' O ' ' A' ' 61' ' ' SER . 55.0 m 179.47 -33.24 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.364 -0.835 . . . . 0.0 109.384 -179.77 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . 0.475 ' HB2' ' O ' ' A' ' 62' ' ' THR . 0.8 OUTLIER 70.63 60.91 0.2 Allowed 'General case' 0 C--O 1.23 0.077 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.724 179.548 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.476 ' HA ' ' CE1' ' A' ' 4' ' ' HIS . 5.5 ptmm? 178.82 39.71 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.647 179.267 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 2.3 m -103.01 17.71 23.41 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.04 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 6.6 p-10 -137.55 87.1 17.94 Favored Pre-proline 0 C--N 1.332 -0.186 0 CA-C-O 120.727 0.299 . . . . 0.0 111.481 -179.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -79.61 -42.32 0.17 Allowed 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.687 2.258 . . . . 0.0 112.041 179.71 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 53.6 m80 -133.28 162.03 60.17 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.534 179.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . 0.425 ' HB3' ' C ' ' B' ' 191' ' ' THR . 75.7 Cg_exo -49.39 -63.75 0.27 Allowed 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.414 2.076 . . . . 0.0 112.615 -179.859 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.437 ' HB2' ' HB3' ' A' ' 38' ' ' LYS . 0.0 OUTLIER -88.57 -159.19 0.53 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.834 -179.809 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 39.9 tt0 -96.7 41.69 1.1 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.803 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.03 110.29 2.86 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.859 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -71.12 145.29 48.99 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.467 2.111 . . . . 0.0 112.3 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.131 0 CA-C-O 118.354 -1.248 . . . . 0.0 112.541 -179.988 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 181' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 . . . . . 0 N--CA 1.487 1.397 0 CA-C-O 120.927 0.394 . . . . 0.0 111.16 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 182' ' ' ARG . . . . . . . . . . . . . 1.7 tpp180 66.26 -75.99 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.832 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 183' ' ' GLY . . . . . . . . . . . . . . . 85.76 26.96 33.37 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.425 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 184' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -60.97 177.02 0.36 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.801 0.334 . . . . 0.0 110.85 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 185' ' ' LYS . . . . . 0.418 ' O ' ' CD2' ' B' ' 186' ' ' HIS . 0.0 OUTLIER -174.38 -59.48 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.135 179.959 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 186' ' ' HIS . . . . . 0.418 ' CD2' ' O ' ' B' ' 185' ' ' LYS . 14.1 m80 -142.91 92.37 2.39 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.737 0.304 . . . . 0.0 111.197 -179.839 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 187' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -59.45 -71.39 0.13 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.963 0.411 . . . . 0.0 110.445 179.582 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 188' ' ' VAL . . . . . 0.422 HG23 ' CE2' ' B' ' 190' ' ' TYR . 0.2 OUTLIER -79.68 -165.91 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.496 179.691 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 189' ' ' TYR . . . . . . . . . . . . . 35.4 m-85 -104.74 98.78 8.47 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.769 0.319 . . . . 0.0 111.574 -179.431 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 190' ' ' TYR . . . . . 0.422 ' CE2' HG23 ' B' ' 188' ' ' VAL . 0.0 OUTLIER -123.39 105.26 9.67 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.515 179.265 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 191' ' ' THR . . . . . 0.425 ' C ' ' HB3' ' A' ' 69' ' ' PRO . 0.9 OUTLIER -90.27 17.48 7.09 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.519 -179.982 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 192' ' ' CYS . . . . . 0.719 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.0 OUTLIER -43.22 174.01 0.0 OUTLIER 'General case' 0 CA--C 1.5 -0.962 0 CA-C-O 122.015 0.912 . . . . 0.0 112.198 -179.713 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 193' ' ' CYS . . . . . 0.719 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.0 OUTLIER 47.18 82.45 0.23 Allowed Pre-proline 0 N--CA 1.438 -1.037 0 CA-C-N 113.466 -1.697 . . . . 0.0 111.945 173.799 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 194' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -53.81 172.55 0.25 Allowed 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.677 2.251 . . . . 0.0 112.482 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 195' ' ' ASP . . . . . 0.402 ' HB2' ' CD ' ' B' ' 197' ' ' PRO . 8.5 m-20 -71.6 -161.83 0.07 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.815 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 196' ' ' THR . . . . . 0.783 ' C ' ' H ' ' B' ' 198' ' ' TYR . 41.5 p -89.83 -5.17 0.1 Allowed Pre-proline 0 CA--C 1.532 0.256 0 N-CA-C 113.793 1.034 . . . . 0.0 113.793 -179.337 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 197' ' ' PRO . . . . . 0.669 ' CD ' ' N ' ' B' ' 196' ' ' THR . 22.8 Cg_exo -62.29 20.98 0.05 OUTLIER 'Trans proline' 0 C--N 1.357 1.014 0 CA-C-N 120.944 1.373 . . . . 0.0 110.282 177.327 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 198' ' ' TYR . . . . . 0.783 ' H ' ' C ' ' B' ' 196' ' ' THR . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.056 0 CA-C-N 114.713 -1.13 . . . . 0.0 110.931 -179.342 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 1.7 mp . . . . . 0 N--CA 1.486 1.341 0 CA-C-O 120.953 0.406 . . . . 0.0 111.139 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . 0.431 HG23 ' HA ' ' A' ' 15' ' ' THR . 0.3 OUTLIER -160.87 178.15 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.191 -179.914 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 4.6 m -67.82 -159.7 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.252 179.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . 0.457 ' CE1' ' ND2' ' A' ' 66' ' ' ASN . 0.0 OUTLIER -156.84 142.05 17.28 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-O 121.263 0.554 . . . . 0.0 112.122 179.978 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.582 ' HB ' ' HA ' ' A' ' 11' ' ' ILE . 13.4 p -53.98 -31.03 49.48 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.428 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.56 -6.55 1.14 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.61 179.188 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.427 ' H ' ' C ' ' A' ' 5' ' ' THR . . . -73.0 132.62 43.63 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.199 179.945 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 89.4 m 64.03 -77.23 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.077 179.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.529 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.0 OUTLIER -101.3 172.65 4.26 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.629 -179.98 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.529 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 10.6 Cg_endo -51.69 -42.77 55.0 Favored 'Trans proline' 0 C--N 1.345 0.392 0 C-N-CA 122.383 2.055 . . . . 0.0 111.456 179.509 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.582 ' HA ' ' HB ' ' A' ' 5' ' ' THR . 11.3 mt -149.45 126.03 2.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.636 179.526 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.488 ' H ' ' HB ' ' A' ' 5' ' ' THR . 0.9 OUTLIER -138.6 -17.56 1.12 Allowed 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 112.425 0.528 . . . . 0.0 112.425 -179.462 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 56.76 58.0 4.38 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.976 0.417 . . . . 0.0 110.819 -179.603 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.522 ' CG2' ' O ' ' A' ' 14' ' ' VAL . 4.6 p -91.69 29.66 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.243 -179.447 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.431 ' HA ' HG23 ' A' ' 2' ' ' VAL . 30.6 p -73.98 120.94 20.25 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.794 0.331 . . . . 0.0 111.299 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.1 t -58.22 141.43 82.28 Favored Pre-proline 0 CA--C 1.532 0.257 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.472 179.592 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.489 ' HB2' ' HD3' ' A' ' 18' ' ' PRO . 38.6 Cg_exo -58.4 -49.93 10.95 Favored 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 122.298 1.999 . . . . 0.0 112.83 -179.542 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.489 ' HD3' ' HB2' ' A' ' 17' ' ' PRO . 89.3 Cg_endo -81.46 -171.82 1.32 Allowed 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.499 2.133 . . . . 0.0 112.412 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -112.73 144.5 17.97 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.175 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 58.14 72.25 0.53 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.921 0.391 . . . . 0.0 110.65 -179.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -119.86 -7.34 10.0 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.647 -179.353 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.588 HD22 ' HA ' ' A' ' 61' ' ' SER . 1.5 mt 61.88 88.33 0.09 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.53 0.205 . . . . 0.0 110.838 179.773 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.437 ' O ' ' HB2' ' A' ' 60' ' ' CYS . 1.7 t -59.5 73.94 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.494 -179.794 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.495 ' CE1' ' HB3' ' A' ' 45' ' ' ALA . 0.0 OUTLIER -114.97 156.59 24.78 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.843 -179.069 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.457 ' HB2' ' C ' ' A' ' 42' ' ' LEU . 2.8 ttt180 -144.7 -81.09 0.17 Allowed 'General case' 0 CA--C 1.53 0.208 0 CA-C-O 120.836 0.35 . . . . 0.0 111.559 179.146 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 2.8 mtmm -179.77 110.52 0.04 OUTLIER 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.318 -179.725 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' MET . . . . . 0.514 ' N ' ' HB3' ' A' ' 41' ' ' GLU . 0.5 OUTLIER -89.19 122.54 32.58 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.843 -179.586 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -87.58 -179.86 6.4 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.856 0.36 . . . . 0.0 110.986 179.966 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 8.4 m -158.93 -178.04 6.95 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.798 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -109.24 -75.75 0.62 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.842 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -127.37 -70.07 0.72 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.975 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 37.6 t80 -102.27 -29.34 11.74 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.848 179.821 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 62.23 85.62 0.12 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.786 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 11.4 p -98.97 -57.57 2.14 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.976 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 2.3 p -135.11 31.69 3.22 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.991 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 2.8 mtt85 -107.84 -81.41 0.56 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.872 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 49.83 39.37 32.06 Favored Glycine 0 C--N 1.331 0.271 0 C-N-CA 120.818 -0.706 . . . . 0.0 112.775 179.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.529 ' HA ' ' HG2' ' A' ' 70' ' ' LYS . 0.0 OUTLIER -73.33 -179.66 3.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.712 0.291 . . . . 0.0 111.068 -179.814 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.447 ' HB ' ' O ' ' A' ' 38' ' ' LYS . 29.8 t 80.82 -3.55 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.868 -178.561 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 17.9 m 43.09 -172.8 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.461 0.079 0 N-CA-C 112.674 0.62 . . . . 0.0 112.674 179.231 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.514 ' HB3' ' N ' ' A' ' 27' ' ' MET . 0.3 OUTLIER -169.46 89.91 0.2 Allowed 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.716 -179.07 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.457 ' C ' ' HB2' ' A' ' 25' ' ' ARG . 1.6 pp -158.09 127.87 5.97 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-O 121.411 0.624 . . . . 0.0 112.307 179.409 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.432 ' N ' ' O ' ' A' ' 24' ' ' TYR . . . -156.85 -1.34 0.1 OUTLIER Glycine 0 N--CA 1.45 -0.387 0 CA-C-N 115.012 -0.995 . . . . 0.0 112.509 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.468 ' HA ' ' O ' ' A' ' 22' ' ' LEU . 0.7 OUTLIER 59.25 129.86 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.197 0 N-CA-C 113.362 0.875 . . . . 0.0 113.362 178.528 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.495 ' HB3' ' CE1' ' A' ' 24' ' ' TYR . . . -152.92 113.27 4.02 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.091 -0.959 . . . . 0.0 110.237 178.76 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -60.75 78.61 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.97 -179.316 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.442 ' OG1' ' HD3' ' A' ' 49' ' ' PRO . 0.0 OUTLIER 167.71 -77.61 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.688 179.331 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.437 ' N ' ' HD3' ' A' ' 49' ' ' PRO . 0.0 OUTLIER 47.41 63.1 10.75 Favored Pre-proline 0 C--O 1.233 0.209 0 CA-C-O 120.991 0.424 . . . . 0.0 111.944 179.353 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.442 ' HD3' ' OG1' ' A' ' 47' ' ' THR . 74.2 Cg_endo -94.84 11.45 1.62 Allowed 'Trans proline' 0 N--CA 1.451 -1.029 0 C-N-CA 123.371 2.714 . . . . 0.0 110.99 178.62 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 46.2 t -61.89 142.11 57.59 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 115.289 -0.869 . . . . 0.0 111.731 -179.241 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 6.9 mttm -164.94 54.1 0.12 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.178 179.718 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.46 ' CB ' ' HD2' ' A' ' 53' ' ' PRO . 0.0 OUTLIER -112.73 168.37 7.79 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.931 -179.525 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . 0.46 ' HD2' ' CB ' ' A' ' 52' ' ' LYS . 12.5 Cg_endo -55.81 -162.05 0.01 OUTLIER 'Trans proline' 0 C--N 1.348 0.536 0 C-N-CA 122.778 2.318 . . . . 0.0 112.375 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -55.08 89.63 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.177 -179.871 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -102.73 -73.69 0.65 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.524 179.691 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 172.82 -36.15 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.864 179.868 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 5.5 m -92.05 137.24 22.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.132 0.492 . . . . 0.0 111.911 -179.381 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 60.1 p -108.85 -19.53 13.37 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.498 179.235 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . 0.458 ' HA ' ' CB ' ' A' ' 24' ' ' TYR . 5.4 m 69.19 103.94 0.06 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.864 179.767 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.45 ' O ' ' HB3' ' A' ' 22' ' ' LEU . 0.0 OUTLIER -74.37 -160.39 0.1 Allowed 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.703 179.831 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.588 ' HA ' HD22 ' A' ' 22' ' ' LEU . 0.0 OUTLIER 167.72 137.69 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 120.958 0.409 . . . . 0.0 111.623 179.518 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER 35.09 -91.66 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 115.474 -0.784 . . . . 0.0 112.158 179.318 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . 0.41 ' O ' ' N ' ' A' ' 65' ' ' CYS . 9.3 p-10 -55.82 125.64 22.19 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.84 0.353 . . . . 0.0 111.257 -179.689 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 3.3 pttp -56.32 86.98 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.654 179.796 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . 0.41 ' N ' ' O ' ' A' ' 63' ' ' ASP . 0.1 OUTLIER -77.24 58.69 1.66 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.297 -179.641 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.556 ' N ' ' HD3' ' A' ' 67' ' ' PRO . 1.0 OUTLIER -167.06 55.87 0.34 Allowed Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.756 179.24 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . 0.556 ' HD3' ' N ' ' A' ' 66' ' ' ASN . 26.2 Cg_exo -62.03 -65.67 0.06 OUTLIER 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 122.516 2.144 . . . . 0.0 112.41 -179.782 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -110.85 158.32 36.06 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.757 -179.838 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 7.9 Cg_exo -71.09 -74.63 0.01 OUTLIER 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.643 2.229 . . . . 0.0 112.314 -179.691 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.579 ' HD2' ' N ' ' A' ' 70' ' ' LYS . 0.0 OUTLIER 177.41 -102.16 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 116.686 -0.234 . . . . 0.0 111.396 -179.969 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 37.3 tp60 -67.1 89.63 0.18 Allowed 'General case' 0 C--O 1.231 0.086 0 CA-C-O 120.713 0.292 . . . . 0.0 111.216 -179.572 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -162.59 59.04 0.87 Allowed Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.869 179.756 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -63.49 -27.24 70.23 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.511 2.141 . . . . 0.0 112.185 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.143 0 CA-C-O 118.355 -1.247 . . . . 0.0 112.458 179.985 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 181' ' ' TYR . . . . . . . . . . . . . 1.1 p90 . . . . . 0 N--CA 1.486 1.345 0 CA-C-O 120.745 0.307 . . . . 0.0 111.196 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 182' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 71.57 32.99 1.92 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.719 -179.806 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 183' ' ' GLY . . . . . . . . . . . . . . . -107.65 -15.37 15.36 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.769 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 184' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -56.25 155.95 6.25 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.802 0.334 . . . . 0.0 111.052 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 185' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -146.57 -165.83 2.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.962 179.813 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 186' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -140.04 86.61 2.1 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.942 -179.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 187' ' ' TRP . . . . . . . . . . . . . 48.3 p90 -74.89 162.48 28.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.055 0.455 . . . . 0.0 111.055 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 188' ' ' VAL . . . . . 0.431 ' CG1' ' CE2' ' B' ' 190' ' ' TYR . 0.1 OUTLIER -97.94 161.09 2.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.914 -179.869 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 189' ' ' TYR . . . . . 0.445 ' O ' ' CG1' ' A' ' 39' ' ' VAL . 12.4 m-85 -112.18 -8.36 13.99 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.534 179.444 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 190' ' ' TYR . . . . . 0.467 ' N ' ' CD1' ' B' ' 190' ' ' TYR . 0.0 OUTLIER -79.48 143.32 35.03 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 120.853 0.358 . . . . 0.0 110.692 -179.653 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 191' ' ' THR . . . . . . . . . . . . . 1.4 t -73.83 -25.35 60.04 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.97 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 192' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -45.31 178.31 0.0 OUTLIER 'General case' 0 CA--C 1.504 -0.811 0 CA-C-O 122.03 0.919 . . . . 0.0 112.347 -179.923 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 193' ' ' CYS . . . . . 0.48 ' N ' ' HD3' ' B' ' 194' ' ' PRO . 0.6 OUTLIER 31.24 58.42 1.07 Allowed Pre-proline 0 N--CA 1.438 -1.049 0 CA-C-N 112.782 -2.008 . . . . 0.0 113.209 172.609 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 194' ' ' PRO . . . . . 0.48 ' HD3' ' N ' ' B' ' 193' ' ' CYS . 57.1 Cg_endo -90.53 -68.31 0.01 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.801 0 C-N-CA 122.779 2.319 . . . . 0.0 112.502 179.9 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 178.94 129.77 0.07 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.84 0.352 . . . . 0.0 110.801 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 196' ' ' THR . . . . . 0.661 ' N ' ' HD3' ' B' ' 197' ' ' PRO . 11.4 t -139.4 46.2 1.04 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.95 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 197' ' ' PRO . . . . . 0.661 ' HD3' ' N ' ' B' ' 196' ' ' THR . 5.7 Cg_exo -73.54 12.62 0.84 Allowed 'Trans proline' 0 C--N 1.35 0.639 0 C-N-CA 121.688 1.592 . . . . 0.0 108.699 175.963 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 198' ' ' TYR . . . . . 0.58 ' H ' ' C ' ' B' ' 196' ' ' THR . 8.2 t80 . . . . . 0 C--O 1.249 1.076 0 CA-C-N 113.963 -1.471 . . . . 0.0 111.273 -178.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . 0.416 HD13 HG22 ' A' ' 1' ' ' ILE . 29.0 mm . . . . . 0 N--CA 1.486 1.369 0 CA-C-O 120.729 0.299 . . . . 0.0 111.07 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . 0.464 ' CG2' ' HA ' ' A' ' 15' ' ' THR . 3.6 p -172.37 170.69 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.002 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.406 ' HB2' ' ND2' ' A' ' 66' ' ' ASN . 1.4 p -113.3 -162.14 0.79 Allowed 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 116.649 -0.25 . . . . 0.0 111.112 -179.521 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . 0.51 ' HA ' HG21 ' A' ' 14' ' ' VAL . 1.6 p80 -146.3 -175.96 4.98 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.874 0.369 . . . . 0.0 111.089 -179.851 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.464 ' HB ' ' CG1' ' A' ' 14' ' ' VAL . 0.1 OUTLIER -97.9 80.97 2.8 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.69 179.963 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 96.7 m -89.77 -3.68 58.04 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.826 179.705 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -79.4 131.66 36.16 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.738 0.304 . . . . 0.0 110.828 179.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 5.1 p 56.67 26.44 11.26 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.696 -179.647 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 81.1 p -169.4 151.15 4.39 Favored Pre-proline 0 C--N 1.33 -0.24 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.886 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.404 ' CG ' ' CG2' ' B' ' 196' ' ' THR . 34.9 Cg_endo -65.32 -54.01 0.7 Allowed 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.668 2.246 . . . . 0.0 112.633 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 20.0 tt -154.86 152.3 9.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.312 -179.738 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.46 ' CB ' HG21 ' A' ' 5' ' ' THR . 4.3 m -176.53 -158.36 0.05 Allowed 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.163 -179.915 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -136.27 135.17 38.77 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-O 120.822 0.344 . . . . 0.0 111.417 -179.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.51 HG21 ' HA ' ' A' ' 4' ' ' HIS . 21.1 m -117.24 -53.78 4.27 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.141 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.656 179.695 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.464 ' HA ' ' CG2' ' A' ' 2' ' ' VAL . 1.2 p 29.69 79.01 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 122.645 0.378 . . . . 0.0 111.875 -179.781 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.43 ' HA ' ' HD2' ' A' ' 17' ' ' PRO . 1.4 m -39.16 96.13 0.11 Allowed Pre-proline 0 CA--C 1.533 0.297 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.874 -179.5 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.565 ' N ' ' HD2' ' A' ' 18' ' ' PRO . 6.8 Cg_endo -53.26 -49.29 17.99 Favored 'Trans proline' 0 C--N 1.348 0.542 0 C-N-CA 122.679 2.253 . . . . 0.0 113.843 -179.393 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.565 ' HD2' ' N ' ' A' ' 17' ' ' PRO . 12.3 Cg_endo -55.83 -80.34 0.02 OUTLIER 'Trans proline' 0 C--N 1.349 0.582 0 C-N-CA 122.186 1.924 . . . . 0.0 112.733 -179.162 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -151.8 -148.31 4.8 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.49 -0.862 . . . . 0.0 112.65 -179.789 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 58.36 -179.39 0.07 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.798 0.332 . . . . 0.0 110.663 -179.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 14.0 p30 -177.25 39.29 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.898 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -146.72 81.67 1.56 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.758 179.935 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.735 ' HA ' ' H ' ' A' ' 44' ' ' CYS . 6.5 m -58.02 120.66 8.95 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.994 -179.698 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.48 ' CD1' ' N ' ' A' ' 25' ' ' ARG . 0.4 OUTLIER -133.47 -32.66 1.14 Allowed 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 113.032 0.753 . . . . 0.0 113.032 -178.303 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.607 ' HB2' ' C ' ' A' ' 42' ' ' LEU . 1.6 ttm180 37.1 -117.55 0.15 Allowed 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 112.677 0.621 . . . . 0.0 112.677 -178.504 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.417 ' C ' ' HB3' ' A' ' 41' ' ' GLU . 0.0 OUTLIER -156.41 126.49 6.48 Favored 'General case' 0 C--N 1.344 0.332 0 C-N-CA 122.351 0.26 . . . . 0.0 110.574 -179.513 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' MET . . . . . 0.463 ' HB2' ' CG ' ' A' ' 41' ' ' GLU . 3.0 tmm? -104.92 159.33 15.89 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.606 0.241 . . . . 0.0 110.881 -179.688 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' TRP . . . . . 0.413 ' O ' ' HA2' ' A' ' 37' ' ' GLY . 3.2 t-105 -130.21 143.71 50.94 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.904 0.383 . . . . 0.0 111.286 179.84 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . 0.494 ' HB3' ' N ' ' A' ' 37' ' ' GLY . 0.0 OUTLIER 61.48 131.98 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.853 -179.9 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 3.7 t0 -178.76 -177.94 0.54 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.747 179.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . 64.28 -80.8 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.287 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -120.54 56.58 0.98 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.838 0.351 . . . . 0.0 111.033 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 46.4 t -127.04 83.63 2.19 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.909 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 37.2 p -48.59 -43.11 35.73 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-O 120.948 0.404 . . . . 0.0 110.697 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.445 ' O ' ' C ' ' A' ' 36' ' ' ARG . 0.3 OUTLIER -93.27 -151.01 0.29 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.921 179.335 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.453 ' HB3' ' CB ' ' A' ' 29' ' ' CYS . 0.3 OUTLIER 28.6 -139.97 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 122.593 0.357 . . . . 0.0 111.62 179.178 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.494 ' N ' ' HB3' ' A' ' 29' ' ' CYS . . . 65.35 9.23 41.83 Favored Glycine 0 C--N 1.338 0.66 0 C-N-CA 120.041 -1.076 . . . . 0.0 113.17 179.839 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.562 ' HB2' ' CB ' ' B' ' 190' ' ' TYR . 0.0 OUTLIER -99.61 -1.66 37.57 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 117.071 0.436 . . . . 0.0 110.991 179.736 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.518 ' HA ' ' HA ' ' B' ' 190' ' ' TYR . 4.7 t -78.73 86.62 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 CA-C-O 120.974 0.416 . . . . 0.0 110.147 178.907 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.4 ' CG2' ' CG2' ' B' ' 191' ' ' THR . 30.2 m -50.01 -179.93 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.813 -0.63 . . . . 0.0 112.38 -178.681 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.751 ' O ' ' HG3' ' A' ' 41' ' ' GLU . 5.1 pt-20 -157.71 97.82 1.6 Allowed 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 112.462 0.541 . . . . 0.0 112.462 -178.584 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.607 ' C ' ' HB2' ' A' ' 25' ' ' ARG . 0.1 OUTLIER -159.09 112.69 2.33 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.748 0.785 . . . . 0.0 112.833 178.704 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.413 ' N ' ' HB2' ' A' ' 25' ' ' ARG . . . -162.44 26.66 0.24 Allowed Glycine 0 N--CA 1.449 -0.496 0 CA-C-N 114.352 -1.294 . . . . 0.0 111.387 179.413 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.735 ' H ' ' HA ' ' A' ' 23' ' ' CYS . 70.8 m 65.4 140.84 0.02 OUTLIER 'General case' 0 N--CA 1.461 0.115 0 CA-C-O 120.977 0.417 . . . . 0.0 111.685 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.479 ' HB1' ' CE1' ' A' ' 24' ' ' TYR . . . -117.19 -82.47 0.63 Allowed 'General case' 0 C--O 1.232 0.143 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.214 179.779 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 169.22 -39.37 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.897 0.38 . . . . 0.0 110.963 -179.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.7 m -162.71 -7.77 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 116.078 -0.51 . . . . 0.0 112.018 -179.417 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.512 ' N ' ' HD3' ' A' ' 49' ' ' PRO . 1.5 m 64.22 59.35 1.64 Allowed Pre-proline 0 C--N 1.332 -0.186 0 CA-C-O 120.539 0.209 . . . . 0.0 111.234 179.842 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.512 ' HD3' ' N ' ' A' ' 48' ' ' CYS . 2.9 Cg_endo -79.99 -2.02 11.8 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 122.675 2.25 . . . . 0.0 111.473 178.906 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 34.7 t -53.91 144.78 17.88 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.727 -0.669 . . . . 0.0 111.575 -179.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 7.5 pttt 179.99 75.22 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.767 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.413 ' HB2' ' HD2' ' A' ' 53' ' ' PRO . 0.6 OUTLIER -150.49 162.68 26.7 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.837 -179.864 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . 0.413 ' HD2' ' HB2' ' A' ' 52' ' ' LYS . 9.8 Cg_endo -50.81 -72.6 0.04 OUTLIER 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.741 2.294 . . . . 0.0 112.257 179.887 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -55.11 -27.11 42.73 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.953 179.904 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 59.21 -87.31 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.952 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.413 ' O ' HG12 ' A' ' 57' ' ' VAL . 13.3 tt0 72.91 6.53 5.36 Favored 'General case' 0 CA--C 1.528 0.115 0 CA-C-O 120.586 0.232 . . . . 0.0 111.207 -179.868 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.447 HG11 ' CE2' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -169.54 145.92 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-O 120.844 0.354 . . . . 0.0 110.839 179.97 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.406 ' OG1' ' N ' ' A' ' 59' ' ' CYS . 0.0 OUTLIER -145.74 -99.58 0.1 Allowed 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.562 179.655 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . 0.446 ' HA ' ' HB3' ' A' ' 24' ' ' TYR . 0.8 OUTLIER 167.45 172.41 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 120.778 0.323 . . . . 0.0 110.648 179.772 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.514 ' HB2' ' O ' ' A' ' 23' ' ' CYS . 9.7 t -125.05 -86.49 0.63 Allowed 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.117 -179.603 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 19.6 p 53.59 -158.23 0.16 Allowed 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 120.603 0.24 . . . . 0.0 111.223 179.663 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER 46.83 -90.46 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.565 -179.966 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -127.03 -178.74 4.53 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.817 0.342 . . . . 0.0 111.099 -179.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.9 ptpp? -68.22 73.53 0.21 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.854 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 18.0 p -57.28 -31.0 65.16 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.263 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.459 ' HB3' ' CE1' ' A' ' 4' ' ' HIS . 1.5 m-80 -31.16 92.82 0.05 OUTLIER Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 115.656 -0.702 . . . . 0.0 112.477 -178.642 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -90.04 -170.93 0.44 Allowed 'Trans proline' 0 N--CA 1.457 -0.63 0 C-N-CA 123.029 2.486 . . . . 0.0 112.56 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.439 ' HB3' ' HD2' ' A' ' 69' ' ' PRO . 27.3 m80 -110.52 166.01 11.59 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.366 179.707 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . 0.457 ' HD3' ' OG1' ' B' ' 191' ' ' THR . 83.0 Cg_exo -49.13 133.1 28.99 Favored 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 122.393 2.062 . . . . 0.0 112.013 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.421 ' O ' ' N ' ' A' ' 72' ' ' ARG . 0.1 OUTLIER -46.73 -41.13 14.66 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.473 -179.463 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -65.13 73.61 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.682 179.915 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.421 ' N ' ' O ' ' A' ' 70' ' ' LYS . 0.0 OUTLIER -61.89 147.71 89.19 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.045 -179.852 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -68.89 -25.73 32.51 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 122.586 2.191 . . . . 0.0 112.274 179.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.118 0 CA-C-O 118.346 -1.252 . . . . 0.0 112.386 179.98 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 181' ' ' TYR . . . . . . . . . . . . . 4.3 m-85 . . . . . 0 N--CA 1.485 1.315 0 CA-C-O 120.846 0.355 . . . . 0.0 111.213 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 182' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -58.31 -166.68 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.931 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 183' ' ' GLY . . . . . . . . . . . . . . . 166.69 63.63 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.722 -0.752 . . . . 0.0 112.419 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 184' ' ' TRP . . . . . . . . . . . . . 15.2 m95 -136.52 -51.3 0.69 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.738 0.304 . . . . 0.0 110.906 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 185' ' ' LYS . . . . . . . . . . . . . 13.8 tptm 63.54 -78.58 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.829 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 186' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -132.7 70.28 1.47 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.038 0.447 . . . . 0.0 110.699 179.903 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 187' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -60.65 -169.5 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.835 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 188' ' ' VAL . . . . . 0.415 ' CG1' ' CE1' ' B' ' 190' ' ' TYR . 1.5 t -79.67 125.01 38.55 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.305 0 CA-C-O 121.208 0.528 . . . . 0.0 111.561 -179.574 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 189' ' ' TYR . . . . . 0.467 ' CD1' ' CG2' ' A' ' 39' ' ' VAL . 0.1 OUTLIER -117.24 -13.78 10.47 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-N 115.373 -0.831 . . . . 0.0 111.549 -179.433 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 190' ' ' TYR . . . . . 0.562 ' CB ' ' HB2' ' A' ' 38' ' ' LYS . 48.4 p90 -89.41 -178.45 5.6 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.942 0.401 . . . . 0.0 111.927 -179.118 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 191' ' ' THR . . . . . 0.457 ' OG1' ' HD3' ' A' ' 69' ' ' PRO . 7.3 p -77.53 59.03 1.85 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.246 -179.852 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 192' ' ' CYS . . . . . 0.71 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.0 OUTLIER -48.23 174.89 0.01 OUTLIER 'General case' 0 CA--C 1.499 -0.993 0 CA-C-O 121.927 0.87 . . . . 0.0 111.756 179.829 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 193' ' ' CYS . . . . . 0.71 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.0 OUTLIER 46.51 82.13 0.24 Allowed Pre-proline 0 N--CA 1.44 -0.952 0 CA-C-N 113.598 -1.637 . . . . 0.0 112.043 173.602 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 194' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -83.54 52.5 3.86 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.899 2.399 . . . . 0.0 112.644 -179.763 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -178.5 110.72 0.06 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.883 0.373 . . . . 0.0 111.4 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 196' ' ' THR . . . . . 0.589 ' C ' ' H ' ' B' ' 198' ' ' TYR . 4.9 t -152.75 41.9 0.2 Allowed Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.648 179.698 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 197' ' ' PRO . . . . . 0.519 ' CD ' ' N ' ' B' ' 196' ' ' THR . 74.4 Cg_endo -72.77 11.47 0.85 Allowed 'Trans proline' 0 C--N 1.348 0.526 0 C-N-CA 121.607 1.538 . . . . 0.0 108.951 176.277 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 198' ' ' TYR . . . . . 0.589 ' H ' ' C ' ' B' ' 196' ' ' THR . 0.9 OUTLIER . . . . . 0 C--O 1.248 1.019 0 CA-C-N 113.9 -1.5 . . . . 0.0 111.153 -179.088 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 4.5 mp . . . . . 0 N--CA 1.486 1.363 0 CA-C-O 120.704 0.288 . . . . 0.0 111.055 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . 0.462 ' CG1' ' CG1' ' A' ' 14' ' ' VAL . 53.4 t 62.53 144.47 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.807 -179.925 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.458 ' N ' HG11 ' A' ' 2' ' ' VAL . 14.5 p -117.48 24.67 10.95 Favored 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 113.34 0.866 . . . . 0.0 113.34 -178.079 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . 0.569 ' HA ' ' CG1' ' A' ' 14' ' ' VAL . 0.0 OUTLIER 68.07 162.7 0.2 Allowed 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 118.185 0.448 . . . . 0.0 110.073 -179.757 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.408 HG21 ' C ' ' A' ' 12' ' ' SER . 1.3 p -78.82 -161.96 0.34 Allowed 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 110.361 -0.237 . . . . 0.0 110.361 -179.95 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 16.9 p -74.98 53.7 0.62 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.769 0.319 . . . . 0.0 111.106 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 48.24 -148.15 0.22 Allowed 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 116.484 -0.326 . . . . 0.0 110.897 179.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.474 HG23 ' HD2' ' B' ' 194' ' ' PRO . 0.2 OUTLIER 75.06 159.0 0.21 Allowed 'General case' 0 N--CA 1.461 0.099 0 CA-C-O 121.14 0.495 . . . . 0.0 111.324 179.585 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.611 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 1.5 p -72.42 -44.9 10.18 Favored Pre-proline 0 CA--C 1.533 0.319 0 CA-C-N 115.744 -0.662 . . . . 0.0 112.16 -179.773 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.611 ' HD2' ' N ' ' A' ' 9' ' ' SER . 47.9 Cg_endo -66.28 -32.48 41.66 Favored 'Trans proline' 0 C--N 1.35 0.626 0 C-N-CA 122.237 1.958 . . . . 0.0 112.652 -179.485 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.402 ' CG2' ' CG2' ' A' ' 5' ' ' THR . 2.3 mt 76.48 161.24 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.501 -179.638 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.408 ' C ' HG21 ' A' ' 5' ' ' THR . 34.3 t -136.91 -120.41 0.15 Allowed 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 121.08 -0.248 . . . . 0.0 111.258 -179.644 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -100.17 123.25 44.19 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-O 120.779 0.323 . . . . 0.0 110.978 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.569 ' CG1' ' HA ' ' A' ' 4' ' ' HIS . 0.1 OUTLIER -84.47 172.1 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.239 -179.69 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.405 ' OG1' ' O ' ' A' ' 14' ' ' VAL . 1.6 p 73.29 162.06 0.25 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.312 179.575 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.462 ' HB3' ' CD ' ' A' ' 17' ' ' PRO . 27.2 t -172.01 -60.05 0.0 OUTLIER Pre-proline 0 C--N 1.325 -0.461 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.34 179.867 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.462 ' CD ' ' HB3' ' A' ' 16' ' ' CYS . 19.5 Cg_endo -58.31 106.0 0.24 Allowed 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.382 2.055 . . . . 0.0 112.725 -179.656 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_exo -69.66 -52.81 0.31 Allowed 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.557 2.171 . . . . 0.0 111.399 179.376 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -112.82 -34.5 1.85 Allowed Glycine 0 N--CA 1.45 -0.377 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.999 179.54 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.12 -175.6 1.88 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.786 0.327 . . . . 0.0 110.792 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 21.3 m-20 -123.78 -0.4 8.54 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.647 -179.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.445 ' HB3' ' O ' ' A' ' 60' ' ' CYS . 0.1 OUTLIER -103.81 177.13 4.93 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.773 0.321 . . . . 0.0 110.917 -179.94 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.455 ' HA ' ' HA ' ' A' ' 44' ' ' CYS . 35.6 t -157.88 8.33 0.15 Allowed 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 -179.384 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.459 ' N ' ' HB2' ' A' ' 60' ' ' CYS . 3.2 m-85 52.18 173.09 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 120.643 0.258 . . . . 0.0 111.001 -179.723 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.454 ' HB2' ' O ' ' A' ' 24' ' ' TYR . 0.6 OUTLIER 161.35 104.28 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.907 179.675 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.0 -179.65 0.05 Allowed 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 178.932 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' MET . . . . . 0.474 ' O ' ' O ' ' A' ' 28' ' ' TRP . 0.0 OUTLIER -146.04 44.75 1.25 Allowed 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.114 -0.635 . . . . 0.0 112.405 -179.522 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' TRP . . . . . 0.595 ' HB2' ' HA2' ' A' ' 37' ' ' GLY . 14.3 p-90 45.65 172.3 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 113.482 0.919 . . . . 0.0 113.482 178.28 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER 37.1 -157.72 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 114.855 -1.066 . . . . 0.0 111.996 179.735 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 19.7 t0 -165.95 92.95 0.52 Allowed 'General case' 0 C--N 1.334 -0.096 0 CA-C-O 120.943 0.402 . . . . 0.0 111.206 -179.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . 62.79 140.13 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.709 179.578 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 17.6 t80 45.8 84.07 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 115.934 -0.576 . . . . 0.0 111.488 179.751 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 85.4 m -153.19 133.0 13.17 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.092 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -126.06 -44.21 1.77 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.752 179.888 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 1.2 m -93.13 -51.76 4.88 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.815 179.877 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 5.1 mpt_? -57.65 -170.15 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.728 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.595 ' HA2' ' HB2' ' A' ' 28' ' ' TRP . . . 105.07 -133.95 11.81 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.554 -0.831 . . . . 0.0 113.146 179.666 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.512 ' HD3' ' N ' ' A' ' 38' ' ' LYS . 0.0 OUTLIER 62.58 75.29 0.41 Allowed 'General case' 0 C--N 1.334 -0.085 0 CA-C-O 121.054 0.454 . . . . 0.0 110.914 -179.932 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.564 ' N ' ' HB3' ' A' ' 28' ' ' TRP . 17.5 t -157.47 160.61 2.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.511 -179.954 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.401 ' CG1' ' O ' ' A' ' 39' ' ' VAL . 35.4 m -157.98 175.93 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 116.4 -0.363 . . . . 0.0 110.601 179.912 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 170.9 -179.08 0.05 OUTLIER 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 120.942 0.401 . . . . 0.0 111.321 179.678 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -138.43 178.36 7.2 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.696 179.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.44 ' CA ' ' HB2' ' A' ' 24' ' ' TYR . . . -161.8 -58.52 0.02 OUTLIER Glycine 0 CA--C 1.518 0.233 0 C-N-CA 120.566 -0.826 . . . . 0.0 112.827 179.918 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.455 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 0.9 OUTLIER 66.88 90.18 0.1 Allowed 'General case' 0 C--O 1.232 0.139 0 CA-C-O 121.034 0.445 . . . . 0.0 110.862 -179.783 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.417 ' HB2' ' CE1' ' A' ' 24' ' ' TYR . . . -128.08 -165.04 1.44 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.897 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -141.51 55.52 1.52 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.953 0.406 . . . . 0.0 110.977 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.503 ' OG1' ' HD3' ' A' ' 49' ' ' PRO . 4.0 t -175.12 137.66 0.41 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.631 -179.823 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.71 ' N ' ' HD3' ' A' ' 49' ' ' PRO . 56.5 m -118.54 30.43 0.15 Allowed Pre-proline 0 CA--C 1.537 0.479 0 N-CA-C 113.3 0.852 . . . . 0.0 113.3 -179.664 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.71 ' HD3' ' N ' ' A' ' 48' ' ' CYS . 36.3 Cg_exo -59.05 -16.57 33.59 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 121.703 1.602 . . . . 0.0 111.971 179.068 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 6.6 t -38.17 131.71 1.11 Allowed 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.78 -179.614 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 23.0 mtmm -166.59 -38.98 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.092 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.445 ' CB ' ' CD ' ' A' ' 53' ' ' PRO . 0.0 OUTLIER -117.81 -67.24 0.02 OUTLIER Pre-proline 0 CA--C 1.533 0.299 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.785 -179.416 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . 0.445 ' CD ' ' CB ' ' A' ' 52' ' ' LYS . 21.8 Cg_endo -60.45 -85.43 0.01 OUTLIER 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.137 1.891 . . . . 0.0 112.534 -179.43 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -66.64 80.5 0.1 Allowed 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 120.9 0.381 . . . . 0.0 110.673 -179.962 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -78.99 -78.51 0.15 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.224 -179.636 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -57.08 -21.75 34.18 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.401 -179.571 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.453 ' CG1' ' CD2' ' A' ' 24' ' ' TYR . 61.4 t -54.63 -60.95 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 120.851 0.357 . . . . 0.0 111.003 179.743 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 59.66 111.83 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.693 -179.917 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . 0.414 ' HA ' ' CE1' ' A' ' 24' ' ' TYR . 9.1 p -46.39 -30.17 2.01 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.361 -0.382 . . . . 0.0 111.064 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.501 ' O ' ' CB ' ' A' ' 61' ' ' SER . 0.0 OUTLIER 74.16 172.7 0.28 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.748 179.939 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.501 ' CB ' ' O ' ' A' ' 60' ' ' CYS . 2.8 p 154.06 68.3 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.557 -179.814 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -161.78 173.44 14.61 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.041 -179.899 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -68.85 -42.2 77.43 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.811 179.901 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.414 ' HD2' ' CD2' ' A' ' 4' ' ' HIS . 40.5 mmtm -116.76 84.31 2.12 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.719 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -73.19 -27.09 61.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.178 -179.883 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -128.23 74.09 79.58 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.072 -179.883 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 15.3 Cg_exo -68.57 67.57 1.13 Allowed 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.803 2.335 . . . . 0.0 112.335 -179.817 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 2.5 m-70 61.7 153.94 0.11 Allowed Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.032 179.774 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -59.18 -162.22 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.675 2.25 . . . . 0.0 112.19 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.539 ' O ' ' C ' ' A' ' 71' ' ' GLN . 0.0 OUTLIER -121.91 -33.19 3.6 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.491 179.833 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.539 ' C ' ' O ' ' A' ' 70' ' ' LYS . 1.8 tt0 -4.03 79.53 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 112.785 0.661 . . . . 0.0 112.785 179.908 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.522 ' HG2' ' O ' ' A' ' 71' ' ' GLN . 0.0 OUTLIER 142.98 158.48 0.0 OUTLIER Pre-proline 0 N--CA 1.472 0.673 0 C-N-CA 123.896 0.879 . . . . 0.0 110.075 179.83 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -50.32 -52.85 8.13 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 122.557 2.172 . . . . 0.0 112.374 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.125 0 CA-C-O 118.373 -1.237 . . . . 0.0 112.494 -179.997 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 181' ' ' TYR . . . . . . . . . . . . . 36.6 m-85 . . . . . 0 N--CA 1.487 1.378 0 CA-C-O 120.825 0.345 . . . . 0.0 111.109 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 182' ' ' ARG . . . . . . . . . . . . . 30.5 ttt180 -96.03 -40.73 9.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.793 179.921 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 183' ' ' GLY . . . . . . . . . . . . . . . 104.59 26.38 6.51 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.525 179.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 184' ' ' TRP . . . . . . . . . . . . . 19.1 t90 68.46 -64.93 0.29 Allowed 'General case' 0 C--O 1.232 0.175 0 CA-C-O 120.749 0.309 . . . . 0.0 111.144 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 185' ' ' LYS . . . . . . . . . . . . . 4.9 tttt 72.19 130.67 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.801 -179.878 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 186' ' ' HIS . . . . . . . . . . . . . 56.3 p-80 -87.14 156.4 19.72 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.07 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 187' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -89.98 -164.62 1.19 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.727 179.902 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 188' ' ' VAL . . . . . 0.467 ' CG1' ' CE1' ' B' ' 190' ' ' TYR . 0.2 OUTLIER -79.91 165.94 2.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.021 -179.912 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 189' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -115.4 48.37 1.19 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.903 0.382 . . . . 0.0 111.175 -179.805 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 190' ' ' TYR . . . . . 0.467 ' CE1' ' CG1' ' B' ' 188' ' ' VAL . 3.4 m-30 -87.66 116.21 25.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.259 179.595 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 191' ' ' THR . . . . . . . . . . . . . 53.8 m -90.18 60.01 4.65 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.922 0.392 . . . . 0.0 111.318 -179.591 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 192' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -90.38 -65.85 0.98 Allowed 'General case' 0 CA--C 1.502 -0.899 0 CA-C-O 122.23 1.014 . . . . 0.0 111.557 179.549 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 193' ' ' CYS . . . . . 0.583 ' N ' ' CD ' ' B' ' 194' ' ' PRO . 0.5 OUTLIER -144.12 35.29 0.19 Allowed Pre-proline 0 N--CA 1.43 -1.475 0 CA-C-N 113.025 -1.898 . . . . 0.0 112.826 -172.851 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 194' ' ' PRO . . . . . 0.583 ' CD ' ' N ' ' B' ' 193' ' ' CYS . 92.6 Cg_endo -79.89 -34.31 0.96 Allowed 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 122.312 2.008 . . . . 0.0 112.454 179.821 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -112.64 39.8 2.41 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.402 -179.531 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 196' ' ' THR . . . . . 0.725 ' N ' ' HD3' ' B' ' 197' ' ' PRO . 15.1 t -112.4 21.78 0.08 OUTLIER Pre-proline 0 CA--C 1.531 0.245 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 179.914 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 197' ' ' PRO . . . . . 0.725 ' HD3' ' N ' ' B' ' 196' ' ' THR . 8.0 Cg_exo -67.36 16.4 0.12 Allowed 'Trans proline' 0 C--N 1.357 1.025 0 CA-C-N 120.427 1.188 . . . . 0.0 109.593 176.304 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 198' ' ' TYR . . . . . 0.68 ' H ' ' C ' ' B' ' 196' ' ' THR . 38.4 t80 . . . . . 0 C--O 1.25 1.106 0 CA-C-N 114.554 -1.203 . . . . 0.0 111.23 -178.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 6.8 mm . . . . . 0 N--CA 1.487 1.381 0 CA-C-O 120.822 0.344 . . . . 0.0 111.009 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . 0.503 ' C ' ' HG3' ' A' ' 64' ' ' LYS . 95.8 t -129.35 138.44 54.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.565 179.602 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.488 ' N ' ' HG3' ' A' ' 64' ' ' LYS . 1.3 m -84.11 -174.56 5.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.507 -178.891 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . 0.453 ' CE1' ' HB2' ' A' ' 66' ' ' ASN . 0.0 OUTLIER -149.05 127.08 11.95 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.236 179.648 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -45.99 -50.19 15.18 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.151 -179.82 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 21.8 m 47.34 28.1 1.01 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.92 179.471 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.39 -70.1 0.19 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.057 0.456 . . . . 0.0 110.535 179.546 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 1.1 p -135.35 24.93 3.5 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.133 179.238 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.437 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER 172.66 169.24 0.24 Allowed Pre-proline 0 C--N 1.332 -0.155 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.116 -179.649 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.451 ' O ' ' N ' ' A' ' 12' ' ' SER . 11.2 Cg_endo -53.47 -79.78 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 122.32 2.013 . . . . 0.0 112.007 179.898 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 32.7 mm 61.22 -75.46 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-O 120.683 0.278 . . . . 0.0 111.502 179.737 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.451 ' N ' ' O ' ' A' ' 10' ' ' PRO . 0.7 OUTLIER 64.81 -162.18 0.27 Allowed 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.801 -179.903 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.408 ' CB ' ' O ' ' A' ' 12' ' ' SER . . . 80.72 -4.21 1.79 Allowed 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.705 -179.911 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 15.0 m -48.41 -48.38 13.98 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.094 0 CA-C-O 120.792 0.33 . . . . 0.0 110.788 179.657 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 9.1 p 44.67 101.78 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.994 179.206 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.433 ' CB ' ' HD2' ' A' ' 17' ' ' PRO . 0.8 OUTLIER -91.05 167.06 16.87 Favored Pre-proline 0 C--N 1.327 -0.407 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.636 179.684 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.433 ' HD2' ' CB ' ' A' ' 16' ' ' CYS . 3.4 Cg_exo -40.73 150.08 0.14 Allowed 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 123.094 2.529 . . . . 0.0 112.83 -179.736 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -59.16 -60.54 0.32 Allowed 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.841 2.36 . . . . 0.0 112.826 -179.596 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -58.84 -141.26 0.01 OUTLIER Glycine 0 CA--C 1.518 0.261 0 CA-C-N 116.004 -0.544 . . . . 0.0 113.116 -179.262 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -57.11 -163.74 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.751 0.31 . . . . 0.0 111.234 -179.672 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 4.8 m120 74.23 69.54 0.1 Allowed 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.764 -179.856 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.415 ' HG ' ' HA ' ' A' ' 61' ' ' SER . 3.4 mm? -86.41 178.85 6.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.961 -179.969 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.513 ' HA ' ' HA ' ' A' ' 44' ' ' CYS . 0.8 OUTLIER -55.01 171.44 0.14 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.098 0.475 . . . . 0.0 111.855 -179.266 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.506 ' CD1' ' O ' ' A' ' 57' ' ' VAL . 0.0 OUTLIER -109.61 -162.55 0.81 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.731 -179.655 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -165.88 69.2 0.12 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.962 179.695 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.603 ' O ' ' O ' ' A' ' 40' ' ' VAL . 11.6 tptm -95.39 62.44 2.44 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.814 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' MET . . . . . 0.433 ' N ' ' HB3' ' A' ' 41' ' ' GLU . 6.4 ttt -97.09 90.59 5.21 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' TRP . . . . . 0.506 ' N ' HG13 ' A' ' 39' ' ' VAL . 10.7 t-105 -39.78 -86.5 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 -178.948 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . 0.558 ' N ' HG13 ' A' ' 39' ' ' VAL . 10.4 t 72.76 154.01 0.14 Allowed 'General case' 0 N--CA 1.462 0.172 0 CA-C-O 120.691 0.282 . . . . 0.0 110.513 -179.554 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -121.29 111.61 17.58 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.869 0.366 . . . . 0.0 111.367 -179.596 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . 57.15 -86.39 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.348 179.683 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 6.3 p90 -108.15 131.31 54.77 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.896 0.379 . . . . 0.0 110.805 -179.845 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -86.44 -166.23 1.49 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.904 -179.969 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 76.42 99.37 0.07 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.354 -179.551 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 4.7 p 60.83 32.12 20.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.539 -179.51 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 9.1 tpt85 -96.1 -84.99 0.34 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.214 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -123.4 -14.63 3.93 Favored Glycine 0 C--N 1.334 0.459 0 C-N-CA 120.388 -0.91 . . . . 0.0 113.56 -179.504 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.459 ' HA ' ' HG3' ' A' ' 70' ' ' LYS . 0.0 OUTLIER 59.46 58.58 2.91 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 117.188 0.494 . . . . 0.0 110.434 -179.621 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.579 ' HA ' ' HA ' ' B' ' 189' ' ' TYR . 9.1 p -82.09 145.61 8.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.671 -179.324 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.603 ' O ' ' O ' ' A' ' 26' ' ' LYS . 3.2 m -81.33 163.96 3.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 N-CA-C 112.304 0.483 . . . . 0.0 112.304 -179.796 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.447 ' HB2' ' N ' ' A' ' 26' ' ' LYS . 1.6 pt-20 -153.43 -154.03 0.5 Allowed 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 115.085 -0.962 . . . . 0.0 109.964 -179.371 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 37.9 mt 66.75 136.03 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 121.069 0.462 . . . . 0.0 111.655 179.46 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 176.75 14.13 0.02 OUTLIER Glycine 0 CA--C 1.525 0.672 0 C-N-CA 120.863 -0.684 . . . . 0.0 113.584 179.589 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.513 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 1.3 m 61.06 150.42 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 117.379 0.589 . . . . 0.0 111.222 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.504 ' HB2' ' CD1' ' A' ' 24' ' ' TYR . . . -135.2 -167.74 2.06 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.481 -179.445 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -114.78 -28.33 7.12 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.899 179.527 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.423 ' OG1' ' N ' ' A' ' 48' ' ' CYS . 1.8 t -158.09 -120.49 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.464 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.423 ' N ' ' OG1' ' A' ' 47' ' ' THR . 2.1 t -178.01 65.19 0.19 Allowed Pre-proline 0 C--O 1.231 0.119 0 CA-C-O 120.812 0.339 . . . . 0.0 111.103 -179.921 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -78.78 14.33 1.71 Allowed 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.575 2.184 . . . . 0.0 111.544 178.811 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.407 ' HB2' HG23 ' A' ' 58' ' ' THR . 31.5 t -61.0 135.71 57.87 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.584 -0.734 . . . . 0.0 111.415 -179.608 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 6.4 pttt 171.15 44.15 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.687 179.72 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.56 165.63 17.16 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.875 -179.87 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_exo -60.03 -68.08 0.05 OUTLIER 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 122.562 2.175 . . . . 0.0 112.339 -179.831 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -69.28 99.61 1.2 Allowed 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.53 179.948 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.444 ' HB3' HG22 ' A' ' 58' ' ' THR . 3.7 mm-40 -109.96 -107.7 0.35 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.241 -179.554 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.472 ' O ' ' CG2' ' A' ' 57' ' ' VAL . 0.4 OUTLIER 60.63 64.57 1.16 Allowed 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 120.827 0.346 . . . . 0.0 110.513 -179.825 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.506 ' O ' ' CD1' ' A' ' 24' ' ' TYR . 0.9 OUTLIER 164.89 -30.54 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.286 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.192 -179.509 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.444 HG22 ' HB3' ' A' ' 55' ' ' GLU . 71.9 p -33.72 157.89 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 115.616 -0.72 . . . . 0.0 112.512 -179.417 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 2.6 p -51.96 -173.79 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.919 -179.509 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -163.56 70.08 0.22 Allowed 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.616 179.992 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.528 ' O ' ' CB ' ' A' ' 62' ' ' THR . 9.7 p -88.21 128.68 35.46 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.6 -179.492 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' THR . . . . . 0.528 ' CB ' ' O ' ' A' ' 61' ' ' SER . 6.0 t 144.41 -146.13 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 108.458 -0.942 . . . . 0.0 108.458 -179.758 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . 0.425 ' N ' ' OG1' ' A' ' 62' ' ' THR . 19.9 m-20 -74.38 55.39 0.62 Allowed 'General case' 0 C--N 1.332 -0.196 0 N-CA-C 109.684 -0.488 . . . . 0.0 109.684 178.581 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.503 ' HG3' ' C ' ' A' ' 2' ' ' VAL . 1.7 mmtp 36.05 45.46 0.31 Allowed 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 115.387 -0.824 . . . . 0.0 112.479 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . 0.435 ' HB2' ' HD3' ' A' ' 67' ' ' PRO . 0.0 OUTLIER 50.19 -82.63 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 115.481 -0.781 . . . . 0.0 112.301 178.651 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.465 ' N ' ' HD3' ' A' ' 67' ' ' PRO . 1.0 OUTLIER 52.98 57.61 14.56 Favored Pre-proline 0 CA--C 1.532 0.283 0 CA-C-O 120.752 0.311 . . . . 0.0 111.178 -179.589 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . 0.465 ' HD3' ' N ' ' A' ' 66' ' ' ASN . 63.8 Cg_endo -92.38 18.3 1.11 Allowed 'Trans proline' 0 N--CA 1.458 -0.616 0 C-N-CA 122.98 2.453 . . . . 0.0 113.142 -179.552 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.408 ' HB3' ' HD2' ' A' ' 69' ' ' PRO . 79.7 m80 60.83 158.63 0.11 Allowed Pre-proline 0 C--N 1.33 -0.243 0 CA-C-N 116.698 -0.228 . . . . 0.0 110.65 -179.793 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . 0.446 ' O ' ' N ' ' A' ' 71' ' ' GLN . 58.8 Cg_endo -71.82 64.12 3.18 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.424 2.082 . . . . 0.0 112.506 -179.706 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.515 ' O ' ' N ' ' A' ' 72' ' ' ARG . 2.4 mmmm 50.67 -87.66 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.174 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.446 ' N ' ' O ' ' A' ' 69' ' ' PRO . 8.2 tp-100 52.21 -80.78 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.173 0 CA-C-N 116.641 -0.254 . . . . 0.0 111.682 179.409 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.515 ' N ' ' O ' ' A' ' 70' ' ' LYS . 1.0 OUTLIER -44.25 110.1 0.95 Allowed Pre-proline 0 CA--C 1.531 0.224 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.246 179.982 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_exo -56.94 -162.09 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.523 2.149 . . . . 0.0 112.311 -179.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.111 0 CA-C-O 118.371 -1.238 . . . . 0.0 112.511 -179.951 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 181' ' ' TYR . . . . . . . . . . . . . 7.7 p90 . . . . . 0 N--CA 1.487 1.414 0 CA-C-O 120.82 0.343 . . . . 0.0 111.163 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 182' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.78 80.03 4.25 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.908 -179.977 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 183' ' ' GLY . . . . . . . . . . . . . . . -99.51 32.72 6.86 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.346 179.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 184' ' ' TRP . . . . . . . . . . . . . 5.1 m95 -111.1 -160.99 0.73 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.644 0.259 . . . . 0.0 110.794 -179.849 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 185' ' ' LYS . . . . . . . . . . . . . 1.7 tttm 64.64 142.01 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.87 0.367 . . . . 0.0 111.004 179.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 186' ' ' HIS . . . . . . . . . . . . . 3.8 m170 -103.25 172.07 7.02 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.866 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 187' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -89.98 -178.42 5.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.82 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -79.96 -44.99 22.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.708 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 189' ' ' TYR . . . . . 0.579 ' HA ' ' HA ' ' A' ' 39' ' ' VAL . 0.1 OUTLIER -79.56 129.79 34.79 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.967 179.978 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 190' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -156.63 15.91 0.31 Allowed 'General case' 0 CA--C 1.53 0.189 0 N-CA-C 112.924 0.713 . . . . 0.0 112.924 -179.87 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 191' ' ' THR . . . . . 0.47 ' N ' HG12 ' A' ' 40' ' ' VAL . 0.0 OUTLIER -90.34 81.57 6.03 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.853 0.359 . . . . 0.0 110.74 179.477 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 192' ' ' CYS . . . . . 0.701 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.5 OUTLIER -90.41 -57.6 2.78 Favored 'General case' 0 CA--C 1.497 -1.059 0 CA-C-O 122.045 0.926 . . . . 0.0 111.473 -179.92 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 193' ' ' CYS . . . . . 0.701 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.0 OUTLIER -155.3 166.7 15.64 Favored Pre-proline 0 N--CA 1.435 -1.203 0 CA-C-N 113.44 -1.709 . . . . 0.0 111.574 -173.647 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 194' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -74.23 -162.41 0.14 Allowed 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.613 2.208 . . . . 0.0 112.365 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 195' ' ' ASP . . . . . 0.402 ' HB2' ' HB3' ' A' ' 9' ' ' SER . 36.9 t70 -133.64 58.52 1.77 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.249 179.622 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 196' ' ' THR . . . . . 0.738 ' C ' ' H ' ' B' ' 198' ' ' TYR . 16.0 p -101.82 12.13 0.06 OUTLIER Pre-proline 0 CA--C 1.534 0.347 0 N-CA-C 113.893 1.072 . . . . 0.0 113.893 -179.508 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 197' ' ' PRO . . . . . 0.695 ' HD3' ' N ' ' B' ' 196' ' ' THR . 13.5 Cg_exo -66.47 22.78 0.1 OUTLIER 'Trans proline' 0 C--N 1.359 1.116 0 CA-C-N 121.014 1.398 . . . . 0.0 109.934 176.85 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 198' ' ' TYR . . . . . 0.738 ' H ' ' C ' ' B' ' 196' ' ' THR . 35.4 t80 . . . . . 0 C--O 1.248 1.011 0 CA-C-N 114.584 -1.189 . . . . 0.0 111.281 -178.797 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . 0.409 ' CG1' ' HA ' ' A' ' 63' ' ' ASP . 1.0 OUTLIER . . . . . 0 N--CA 1.487 1.38 0 CA-C-O 120.396 0.141 . . . . 0.0 110.924 . . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . 0.439 HG12 ' N ' ' A' ' 15' ' ' THR . 84.1 t -42.49 159.7 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.462 0.171 0 CA-C-O 120.528 0.204 . . . . 0.0 111.29 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.4 ' N ' ' CG1' ' A' ' 2' ' ' VAL . 49.7 t -158.06 41.89 0.28 Allowed 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 112.582 0.586 . . . . 0.0 112.582 -178.716 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . 0.561 ' HA ' ' CG1' ' A' ' 14' ' ' VAL . 0.1 OUTLIER 49.95 -176.91 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.82 0.343 . . . . 0.0 111.687 179.105 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 17.1 p -63.55 -132.05 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.7 179.782 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 6.4 p -96.15 30.84 2.33 Favored 'General case' 0 CA--C 1.528 0.121 0 CA-C-O 120.812 0.339 . . . . 0.0 111.106 -179.857 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 60.93 52.75 4.02 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.911 0.386 . . . . 0.0 111.098 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 25.5 p -96.35 -164.46 1.16 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.721 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.475 ' CB ' ' CD ' ' A' ' 10' ' ' PRO . 0.6 OUTLIER -74.09 -67.35 0.41 Allowed Pre-proline 0 C--N 1.332 -0.181 0 CA-C-N 116.676 -0.238 . . . . 0.0 110.872 -179.981 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.475 ' CD ' ' CB ' ' A' ' 9' ' ' SER . 49.1 Cg_endo -79.28 -129.59 0.01 OUTLIER 'Trans proline' 0 CA--C 1.535 0.536 0 C-N-CA 122.396 2.064 . . . . 0.0 111.723 179.856 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.453 ' H ' ' HB2' ' A' ' 10' ' ' PRO . 19.9 pt -159.02 160.66 1.83 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.096 0 CA-C-O 120.625 0.25 . . . . 0.0 110.582 179.846 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 69.8 m -140.5 -84.35 0.22 Allowed 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.963 -0.295 . . . . 0.0 111.358 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -137.37 87.28 2.26 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.803 0.335 . . . . 0.0 110.976 -179.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.561 ' CG1' ' HA ' ' A' ' 4' ' ' HIS . 11.9 m -54.12 172.62 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.321 -179.876 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.439 ' N ' HG12 ' A' ' 2' ' ' VAL . 1.1 p 72.11 150.46 0.1 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.129 179.737 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 4.5 m -112.49 116.34 48.49 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.8 179.757 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.459 ' HB2' ' HD3' ' A' ' 18' ' ' PRO . 37.1 Cg_exo -58.68 -47.58 18.19 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.216 1.944 . . . . 0.0 112.378 179.787 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.459 ' HD3' ' HB2' ' A' ' 17' ' ' PRO . 77.2 Cg_endo -87.16 174.22 5.39 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 122.742 2.295 . . . . 0.0 112.471 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 52.98 -167.06 1.19 Allowed Glycine 0 C--N 1.331 0.276 0 C-N-CA 120.913 -0.66 . . . . 0.0 112.855 179.795 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.48 ' HB2' ' CB ' ' A' ' 46' ' ' ALA . 0.3 OUTLIER -100.21 -153.81 0.46 Allowed 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 110.449 -0.204 . . . . 0.0 110.449 179.813 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 28.9 p-10 -106.19 64.8 0.68 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.748 0.308 . . . . 0.0 111.541 -179.574 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.464 ' O ' ' N ' ' A' ' 24' ' ' TYR . 4.1 mm? -112.89 7.57 18.35 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.295 179.541 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.697 ' HB3' ' HB3' ' A' ' 60' ' ' CYS . 40.0 t 24.19 43.69 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.477 0.711 . . . . 0.0 112.623 179.867 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.58 ' HB3' ' HA3' ' A' ' 43' ' ' GLY . 0.0 OUTLIER -36.32 91.52 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.87 178.733 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.465 ' N ' ' O ' ' A' ' 23' ' ' CYS . 2.0 ptt180 -97.18 98.62 10.18 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.883 0.373 . . . . 0.0 111.28 -179.242 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.446 ' HA ' ' HA ' ' A' ' 57' ' ' VAL . 0.0 OUTLIER -68.53 177.4 2.45 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.088 -0.505 . . . . 0.0 109.713 179.195 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 18.1 ttp -176.77 164.47 2.41 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.806 0.336 . . . . 0.0 110.703 179.812 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' TRP . . . . . 0.427 ' HB2' ' CG2' ' A' ' 39' ' ' VAL . 2.4 t90 -105.74 -137.15 0.36 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.279 179.828 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 71.15 -162.73 0.14 Allowed 'General case' 0 CA--C 1.529 0.165 0 CA-C-O 120.682 0.277 . . . . 0.0 110.558 -179.912 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 173.72 37.36 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.96 179.875 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . 76.29 -54.52 0.6 Allowed 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.498 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -46.24 -28.71 1.35 Allowed 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 111.815 0.302 . . . . 0.0 111.815 -179.591 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -83.84 133.81 34.73 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.87 0.367 . . . . 0.0 110.62 179.784 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 74.2 p -64.42 76.93 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.313 -179.638 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 29.6 t 49.15 59.9 4.13 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.287 179.695 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 4.9 mmm-85 -101.98 -107.53 0.24 Allowed 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.686 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.471 ' O ' HG23 ' A' ' 39' ' ' VAL . . . 76.22 -95.38 1.06 Allowed Glycine 0 C--N 1.335 0.482 0 C-N-CA 120.607 -0.806 . . . . 0.0 113.115 179.745 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.614 ' HG2' ' O ' ' B' ' 189' ' ' TYR . 0.0 OUTLIER 38.72 30.39 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 112.615 0.598 . . . . 0.0 112.615 -179.574 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.471 HG23 ' O ' ' A' ' 37' ' ' GLY . 4.5 t -96.46 7.26 7.63 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-O 120.844 0.354 . . . . 0.0 110.589 178.212 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.579 ' O ' ' HB2' ' A' ' 41' ' ' GLU . 4.8 m 25.4 -145.83 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.657 0 C-N-CA 123.707 0.803 . . . . 0.0 113.097 179.202 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.579 ' HB2' ' O ' ' A' ' 40' ' ' VAL . 0.1 OUTLIER 118.67 106.86 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.082 0.953 . . . . 0.0 110.183 -179.535 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -50.7 179.84 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.396 -179.673 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.58 ' HA3' ' HB3' ' A' ' 24' ' ' TYR . . . -179.43 -78.37 0.06 OUTLIER Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.292 -0.956 . . . . 0.0 113.259 179.907 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.456 ' N ' ' HB2' ' A' ' 24' ' ' TYR . 0.5 OUTLIER 55.44 79.34 0.16 Allowed 'General case' 0 CA--C 1.531 0.221 0 CA-C-O 120.764 0.316 . . . . 0.0 110.684 -179.29 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -96.52 -160.7 0.81 Allowed 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.492 -179.51 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.48 ' CB ' ' HB2' ' A' ' 20' ' ' GLU . . . -167.28 50.41 0.06 Allowed 'General case' 0 C--N 1.333 -0.115 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.452 -179.705 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.542 ' CG2' ' HD3' ' A' ' 49' ' ' PRO . 0.0 OUTLIER 178.41 -33.2 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.137 179.871 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.576 ' N ' ' HD3' ' A' ' 49' ' ' PRO . 85.5 m 68.66 34.32 0.1 Allowed Pre-proline 0 CA--C 1.534 0.341 0 N-CA-C 113.519 0.933 . . . . 0.0 113.519 179.135 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.576 ' HD3' ' N ' ' A' ' 48' ' ' CYS . 44.1 Cg_endo -88.88 13.97 2.37 Favored 'Trans proline' 0 C--N 1.35 0.608 0 C-N-CA 122.08 1.853 . . . . 0.0 110.894 178.106 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.495 ' O ' ' HB2' ' A' ' 51' ' ' LYS . 0.3 OUTLIER -97.05 42.33 1.09 Allowed 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 115.247 -0.888 . . . . 0.0 111.547 -178.726 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.495 ' HB2' ' O ' ' A' ' 50' ' ' SER . 12.5 mttt 74.56 162.53 0.26 Allowed 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.667 -179.638 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.561 ' HB2' ' CD ' ' A' ' 53' ' ' PRO . 0.1 OUTLIER -128.72 -70.51 0.02 OUTLIER Pre-proline 0 CA--C 1.534 0.363 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.891 -179.602 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . 0.561 ' CD ' ' HB2' ' A' ' 52' ' ' LYS . 36.8 Cg_endo -66.67 -61.94 0.08 OUTLIER 'Trans proline' 0 C--N 1.352 0.715 0 C-N-CA 121.987 1.791 . . . . 0.0 112.9 -179.641 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . 0.426 ' CE1' ' HG2' ' A' ' 53' ' ' PRO . 0.0 OUTLIER -52.38 178.8 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 120.916 0.389 . . . . 0.0 111.649 -179.573 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.41 ' O ' ' HG2' ' A' ' 56' ' ' GLU . 4.1 pt-20 41.65 -112.25 0.17 Allowed 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.558 -179.684 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.492 ' O ' ' N ' ' A' ' 58' ' ' THR . 43.1 mm-40 -162.49 -112.62 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 110.225 -0.287 . . . . 0.0 110.225 -179.738 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.474 HG12 ' CD2' ' A' ' 24' ' ' TYR . 21.6 t 58.19 -76.38 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.231 0.094 0 CA-C-O 120.816 0.341 . . . . 0.0 111.574 179.526 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.492 ' N ' ' O ' ' A' ' 56' ' ' GLU . 45.1 p 51.78 26.37 3.47 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.045 -179.722 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . 0.451 ' HA ' ' CD1' ' A' ' 24' ' ' TYR . 2.5 m 50.78 -177.3 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.814 -179.759 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.697 ' HB3' ' HB3' ' A' ' 23' ' ' CYS . 2.2 t -141.19 -94.81 0.14 Allowed 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 116.635 -0.257 . . . . 0.0 110.862 -179.858 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.43 ' HB2' ' HA ' ' A' ' 22' ' ' LEU . 1.6 t 54.25 172.75 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.164 0 CA-C-O 120.892 0.377 . . . . 0.0 111.56 179.394 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' THR . . . . . 0.402 ' N ' ' OG ' ' A' ' 61' ' ' SER . 1.2 m 74.64 79.07 0.11 Allowed 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.243 179.679 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . 0.409 ' HA ' ' CG1' ' A' ' 1' ' ' ILE . 11.5 m-20 52.36 -178.39 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.972 179.881 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.417 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 0.0 OUTLIER -57.35 88.79 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.683 179.851 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 3.2 p -92.13 42.56 1.11 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.466 -179.825 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.417 ' O ' ' CD2' ' A' ' 68' ' ' HIS . 2.3 m-20 -106.67 87.46 2.81 Favored Pre-proline 0 C--N 1.326 -0.433 0 C-N-CA 120.897 -0.321 . . . . 0.0 110.651 179.582 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -73.03 -4.6 15.71 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.727 2.285 . . . . 0.0 113.069 -179.64 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.438 ' CB ' ' CD ' ' A' ' 69' ' ' PRO . 0.3 OUTLIER 64.29 178.56 0.05 OUTLIER Pre-proline 0 C--N 1.331 -0.221 0 N-CA-C 110.396 -0.224 . . . . 0.0 110.396 -179.763 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . 0.438 ' CD ' ' CB ' ' A' ' 68' ' ' HIS . 77.7 Cg_exo -50.24 123.22 10.67 Favored 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.377 2.051 . . . . 0.0 112.479 -179.84 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.28 29.97 2.99 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.919 179.868 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 1.5 pp0? -63.51 -39.85 95.52 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.068 -179.857 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 3.3 mmp_? 57.75 98.18 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.995 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -67.3 68.63 0.66 Allowed 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 122.408 2.072 . . . . 0.0 112.29 -179.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.41 -1.217 . . . . 0.0 112.386 -179.959 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 181' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.527 0 CA-C-O 120.769 0.319 . . . . 0.0 111.013 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 182' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -158.9 151.09 21.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.957 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 183' ' ' GLY . . . . . . . . . . . . . . . -159.85 149.03 18.36 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.479 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 184' ' ' TRP . . . . . 0.402 ' CD1' ' N ' ' B' ' 184' ' ' TRP . 0.1 OUTLIER -176.66 170.18 2.45 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.937 0.399 . . . . 0.0 111.034 179.987 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 185' ' ' LYS . . . . . 0.442 ' HD2' ' CD2' ' B' ' 186' ' ' HIS . 0.2 OUTLIER -67.23 -80.6 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.736 179.813 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 186' ' ' HIS . . . . . 0.442 ' CD2' ' HD2' ' B' ' 185' ' ' LYS . 25.5 p80 -139.32 -157.77 0.8 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.414 179.857 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 187' ' ' TRP . . . . . . . . . . . . . 4.8 m0 -47.66 172.2 0.01 OUTLIER 'General case' 0 CA--C 1.528 0.123 0 CA-C-O 120.833 0.349 . . . . 0.0 111.068 179.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 188' ' ' VAL . . . . . 0.426 ' HB ' ' H ' ' B' ' 189' ' ' TYR . 2.4 t -78.91 -113.99 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.465 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.959 -179.457 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 189' ' ' TYR . . . . . 0.614 ' O ' ' HG2' ' A' ' 38' ' ' LYS . 0.4 OUTLIER -79.59 51.09 1.21 Allowed 'General case' 0 N--CA 1.453 -0.312 0 O-C-N 122.223 -0.298 . . . . 0.0 111.274 -179.892 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 190' ' ' TYR . . . . . 0.466 ' HA ' ' O ' ' A' ' 38' ' ' LYS . 9.1 t80 -154.43 87.72 1.19 Allowed 'General case' 0 CA--C 1.516 -0.353 0 CA-C-O 121.425 0.631 . . . . 0.0 110.892 179.84 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 191' ' ' THR . . . . . 0.431 ' CG2' ' CE1' ' B' ' 186' ' ' HIS . 0.0 OUTLIER -91.25 -50.02 6.05 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 115.015 -0.993 . . . . 0.0 111.495 -179.873 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 192' ' ' CYS . . . . . 0.714 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.0 OUTLIER -43.48 171.52 0.0 OUTLIER 'General case' 0 CA--C 1.498 -1.043 0 CA-C-O 122.284 1.04 . . . . 0.0 112.038 -179.448 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 193' ' ' CYS . . . . . 0.714 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.0 OUTLIER 44.72 49.79 6.35 Favored Pre-proline 0 N--CA 1.435 -1.201 0 CA-C-N 113.073 -1.876 . . . . 0.0 112.412 174.05 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 194' ' ' PRO . . . . . 0.487 ' HD3' ' N ' ' B' ' 193' ' ' CYS . 64.0 Cg_endo -87.24 -25.21 1.09 Allowed 'Trans proline' 0 N--CA 1.459 -0.531 0 C-N-CA 122.596 2.197 . . . . 0.0 112.362 179.671 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -94.69 -173.86 3.13 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.265 -179.611 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 196' ' ' THR . . . . . 0.633 ' N ' ' HD3' ' B' ' 197' ' ' PRO . 0.2 OUTLIER -160.36 48.78 0.26 Allowed Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.634 -179.915 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 197' ' ' PRO . . . . . 0.633 ' HD3' ' N ' ' B' ' 196' ' ' THR . 6.0 Cg_exo -74.93 16.75 0.63 Allowed 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 121.879 1.719 . . . . 0.0 108.768 176.182 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 198' ' ' TYR . . . . . 0.614 ' H ' ' C ' ' B' ' 196' ' ' THR . 11.9 t80 . . . . . 0 C--O 1.25 1.08 0 CA-C-N 113.771 -1.559 . . . . 0.0 111.326 -178.659 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.382 0 CA-C-O 120.816 0.341 . . . . 0.0 111.01 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 60.9 t 63.4 159.19 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.826 -179.653 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.499 ' HB3' ' HB2' ' A' ' 64' ' ' LYS . 38.6 m -96.05 177.4 5.75 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.666 -179.657 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . 0.491 ' NE2' ' O ' ' A' ' 63' ' ' ASP . 0.0 OUTLIER -135.62 160.97 36.85 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.652 -0.249 . . . . 0.0 110.594 179.835 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.476 ' CG2' ' N ' ' A' ' 12' ' ' SER . 20.5 p -21.96 134.43 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 113.373 0.879 . . . . 0.0 113.373 -179.753 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 3.7 t -101.02 -15.13 17.56 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.266 178.852 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.442 ' CB ' ' HG3' ' B' ' 194' ' ' PRO . . . -63.85 -161.73 0.01 OUTLIER 'General case' 0 C--O 1.232 0.142 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.905 179.718 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.644 ' O ' ' CB ' ' A' ' 9' ' ' SER . 2.8 t -57.89 -14.67 6.57 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.81 -0.177 . . . . 0.0 111.3 179.787 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.644 ' CB ' ' O ' ' A' ' 8' ' ' THR . 43.9 t 121.36 14.11 0.0 OUTLIER Pre-proline 0 N--CA 1.476 0.857 0 N-CA-C 114.359 1.244 . . . . 0.0 114.359 178.565 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.602 ' CD ' ' N ' ' A' ' 9' ' ' SER . 56.2 Cg_endo -77.42 -88.32 0.0 OUTLIER 'Trans proline' 0 C--N 1.358 1.046 0 CA-C-N 121.209 1.467 . . . . 0.0 112.598 179.758 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 8.4 tt -158.39 136.72 2.94 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.16 0 CA-C-O 120.981 0.419 . . . . 0.0 111.402 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.476 ' N ' ' CG2' ' A' ' 5' ' ' THR . 0.9 OUTLIER -153.95 -168.53 2.99 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.041 -179.933 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -119.21 55.77 0.93 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.019 179.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.451 HG23 ' HA ' ' A' ' 4' ' ' HIS . 0.2 OUTLIER -52.61 -100.71 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.343 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.462 -179.78 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 54.8 p 44.91 91.19 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 120.867 0.365 . . . . 0.0 111.115 -179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.59 ' HB3' ' HD3' ' A' ' 17' ' ' PRO . 14.7 t -120.98 -51.6 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.285 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -179.33 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.59 ' HD3' ' HB3' ' A' ' 16' ' ' CYS . 1.4 Cg_endo -83.47 110.69 1.72 Allowed 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.68 2.253 . . . . 0.0 112.716 -179.196 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -78.0 -63.34 0.03 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.572 0 C-N-CA 122.263 1.976 . . . . 0.0 111.709 179.375 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -134.3 17.01 4.33 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.96 -0.638 . . . . 0.0 112.191 179.32 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.425 ' O ' ' CG ' ' A' ' 21' ' ' ASN . 0.0 OUTLIER 173.17 -165.88 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.702 0.287 . . . . 0.0 110.729 -179.895 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.479 ' HA ' ' HA ' ' A' ' 46' ' ' ALA . 1.4 p30 67.18 3.93 3.42 Favored 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 112.718 0.636 . . . . 0.0 112.718 179.576 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.42 ' HB3' ' N ' ' A' ' 61' ' ' SER . 0.8 OUTLIER 39.04 -161.89 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 178.881 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -121.28 -11.41 8.8 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.008 -179.935 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.574 ' HB2' ' H ' ' A' ' 44' ' ' CYS . 0.9 OUTLIER 46.54 -174.83 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 120.785 0.326 . . . . 0.0 111.229 -179.738 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.428 ' CD ' ' HG3' ' A' ' 67' ' ' PRO . 14.3 ttt-85 172.56 94.77 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.892 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.411 ' CG ' ' N ' ' A' ' 27' ' ' MET . 0.3 OUTLIER -62.11 163.97 7.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.276 179.483 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' MET . . . . . 0.411 ' N ' ' CG ' ' A' ' 26' ' ' LYS . 66.0 ttp -153.71 163.27 40.29 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.607 179.685 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' TRP . . . . . 0.44 ' HB2' ' CG1' ' A' ' 39' ' ' VAL . 0.0 OUTLIER -114.98 -74.15 0.62 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.06 179.963 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 1.5 m 60.32 52.0 5.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.913 0.387 . . . . 0.0 110.715 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.415 ' HB3' ' CE3' ' A' ' 28' ' ' TRP . 3.6 p30 -87.41 157.5 19.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.097 -179.85 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . 57.16 52.44 8.99 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.162 179.712 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER 56.26 97.43 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.795 179.962 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.42 ' O ' ' N ' ' A' ' 35' ' ' SER . 0.3 OUTLIER -56.56 -73.72 0.06 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.058 -179.827 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 16.3 t 55.08 -85.89 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.014 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.42 ' N ' ' O ' ' A' ' 33' ' ' CYS . 56.7 p -101.09 23.82 10.26 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.867 0.365 . . . . 0.0 110.769 179.663 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.41 ' CA ' ' HE3' ' A' ' 70' ' ' LYS . 0.2 OUTLIER -119.7 -163.07 0.96 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.499 179.987 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 122.01 11.38 5.83 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.545 -0.836 . . . . 0.0 112.85 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.86 56.18 2.65 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.037 0.446 . . . . 0.0 110.762 179.797 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.44 ' CG1' ' HB2' ' A' ' 28' ' ' TRP . 23.8 t -122.24 141.3 43.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.725 179.927 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.459 ' CG2' ' HB ' ' B' ' 191' ' ' THR . 35.7 m -141.83 -178.5 1.36 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 120.927 0.394 . . . . 0.0 111.461 -179.871 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 171.93 -28.81 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.057 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 41.8 mt 69.73 158.2 0.17 Allowed 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.808 -179.763 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.457 ' HA3' ' CB ' ' A' ' 24' ' ' TYR . . . -139.64 -65.97 0.04 OUTLIER Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.364 -0.922 . . . . 0.0 113.184 -179.739 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.574 ' H ' ' HB2' ' A' ' 24' ' ' TYR . 24.3 t 51.86 86.94 0.03 OUTLIER 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 117.081 0.44 . . . . 0.0 110.166 -179.539 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.407 ' O ' ' HA ' ' A' ' 21' ' ' ASN . . . -153.56 155.91 37.04 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.966 0.412 . . . . 0.0 111.989 -178.97 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.479 ' HA ' ' HA ' ' A' ' 21' ' ' ASN . . . -85.66 80.13 9.11 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.436 179.941 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.45 ' OG1' ' N ' ' A' ' 48' ' ' CYS . 0.6 OUTLIER -170.58 -179.61 2.99 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.649 179.831 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.676 ' O ' ' N ' ' A' ' 50' ' ' SER . 0.5 OUTLIER 179.02 -48.24 0.0 OUTLIER Pre-proline 0 C--N 1.333 -0.148 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.568 179.934 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.426 ' CD ' ' N ' ' A' ' 48' ' ' CYS . 53.8 Cg_exo -52.28 72.56 0.02 OUTLIER 'Trans proline' 0 C--N 1.351 0.694 0 C-N-CA 122.083 1.855 . . . . 0.0 111.067 179.685 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.676 ' N ' ' O ' ' A' ' 48' ' ' CYS . 28.7 t -118.63 -80.01 0.61 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.378 -0.828 . . . . 0.0 111.258 -178.342 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 10.2 mtmm 58.91 34.21 23.51 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.836 0.351 . . . . 0.0 111.043 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.41 162.44 33.69 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.809 179.925 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -60.32 -67.84 0.05 OUTLIER 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.494 2.129 . . . . 0.0 112.117 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -74.34 -13.25 60.72 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.134 179.937 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 63.17 -80.14 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.941 -179.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.411 ' O ' ' CG2' ' A' ' 57' ' ' VAL . 17.1 tt0 58.81 23.97 11.84 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.986 179.924 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.469 HG13 ' CE1' ' A' ' 24' ' ' TYR . 71.0 t -159.4 -76.6 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.625 -179.881 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 60.15 118.39 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.35 179.785 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . 0.479 ' HA ' ' CD1' ' A' ' 24' ' ' TYR . 1.2 m -50.97 138.76 18.67 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.939 179.67 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.611 ' SG ' ' N ' ' A' ' 65' ' ' CYS . 48.5 t -112.07 -83.91 0.58 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.708 -179.593 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.465 ' O ' ' N ' ' A' ' 63' ' ' ASP . 47.0 t 65.65 -148.32 0.22 Allowed 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.138 -179.32 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' THR . . . . . 0.417 ' CG2' ' C ' ' A' ' 61' ' ' SER . 0.2 OUTLIER 49.09 -86.82 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 122.147 0.179 . . . . 0.0 111.22 -179.806 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . 0.491 ' O ' ' NE2' ' A' ' 4' ' ' HIS . 1.6 p30 -153.64 79.03 1.15 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.666 0.269 . . . . 0.0 111.659 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.499 ' HB2' ' HB3' ' A' ' 3' ' ' CYS . 0.0 OUTLIER 41.19 23.61 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.788 0.662 . . . . 0.0 112.788 179.365 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . 0.611 ' N ' ' SG ' ' A' ' 60' ' ' CYS . 0.5 OUTLIER 69.82 -42.39 0.51 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.722 0.296 . . . . 0.0 111.016 179.998 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.607 ' N ' ' HD3' ' A' ' 67' ' ' PRO . 0.9 OUTLIER 57.37 53.33 6.29 Favored Pre-proline 0 C--O 1.232 0.179 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.677 -179.659 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . 0.607 ' HD3' ' N ' ' A' ' 66' ' ' ASN . 19.5 Cg_endo -92.29 -66.36 0.01 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.945 0 C-N-CA 123.075 2.517 . . . . 0.0 111.521 179.148 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.573 ' HB3' ' HD2' ' A' ' 69' ' ' PRO . 82.5 m-70 58.21 166.24 0.07 OUTLIER Pre-proline 0 C--N 1.331 -0.197 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.087 179.148 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . 0.573 ' HD2' ' HB3' ' A' ' 68' ' ' HIS . 28.2 Cg_exo -35.15 123.72 0.21 Allowed 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 123.1 2.533 . . . . 0.0 113.145 -179.798 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.416 ' HD3' ' N ' ' A' ' 71' ' ' GLN . 0.0 OUTLIER -98.08 -7.18 30.2 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.236 -179.964 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.416 ' N ' ' HD3' ' A' ' 70' ' ' LYS . 2.1 tt0 -76.49 -16.84 59.56 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.424 179.937 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.47 ' HB2' ' HD3' ' A' ' 73' ' ' PRO . 3.9 mmp_? -66.09 -56.06 18.5 Favored Pre-proline 0 CA--C 1.531 0.238 0 CA-C-N 116.618 -0.265 . . . . 0.0 111.618 -179.592 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.47 ' HD3' ' HB2' ' A' ' 72' ' ' ARG . 36.1 Cg_endo -64.53 -46.26 7.56 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 122.182 1.922 . . . . 0.0 112.264 -179.96 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.444 -1.198 . . . . 0.0 112.499 179.995 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 181' ' ' TYR . . . . . . . . . . . . . 5.0 t80 . . . . . 0 N--CA 1.487 1.377 0 CA-C-O 120.771 0.319 . . . . 0.0 111.102 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 182' ' ' ARG . . . . . . . . . . . . . 28.3 ttp85 -149.56 99.74 2.92 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.9 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 183' ' ' GLY . . . . . . . . . . . . . . . -157.03 47.45 0.47 Allowed Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.458 -179.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 184' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -128.24 135.58 49.87 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.847 0.356 . . . . 0.0 110.878 179.925 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 185' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -87.62 -168.26 2.16 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.843 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 186' ' ' HIS . . . . . . . . . . . . . 50.5 t-80 -88.2 -80.79 0.27 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.773 179.876 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 187' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -88.86 166.96 13.63 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 120.827 0.346 . . . . 0.0 110.86 179.807 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -79.88 -71.99 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.434 -179.594 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 189' ' ' TYR . . . . . . . . . . . . . 9.7 m-85 -107.94 153.77 22.57 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.519 -0.31 . . . . 0.0 111.151 -179.638 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 190' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -160.15 104.8 1.5 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 121.169 0.509 . . . . 0.0 111.422 179.738 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 191' ' ' THR . . . . . 0.459 ' HB ' ' CG2' ' A' ' 40' ' ' VAL . 1.3 t -91.08 43.5 1.15 Allowed 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.925 179.314 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 192' ' ' CYS . . . . . 0.706 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.5 OUTLIER -90.21 -56.86 3.05 Favored 'General case' 0 CA--C 1.497 -1.077 0 CA-C-O 121.798 0.809 . . . . 0.0 112.007 -179.401 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 193' ' ' CYS . . . . . 0.706 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.0 OUTLIER -153.98 103.17 2.46 Favored Pre-proline 0 N--CA 1.436 -1.15 0 CA-C-N 113.734 -1.576 . . . . 0.0 111.964 -173.444 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 194' ' ' PRO . . . . . 0.446 ' HD3' ' HB ' ' A' ' 8' ' ' THR . 38.3 Cg_endo -81.74 -66.7 0.02 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.768 0 C-N-CA 122.395 2.063 . . . . 0.0 111.979 179.486 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -172.63 14.88 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 113.294 0.85 . . . . 0.0 113.294 179.819 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 196' ' ' THR . . . . . 0.595 ' C ' ' H ' ' B' ' 198' ' ' TYR . 1.4 t -147.2 36.85 0.17 Allowed Pre-proline 0 C--N 1.334 -0.094 0 C-N-CA 120.389 -0.524 . . . . 0.0 112.024 179.725 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 197' ' ' PRO . . . . . 0.577 ' CD ' ' N ' ' B' ' 196' ' ' THR . 72.1 Cg_endo -72.2 13.7 0.51 Allowed 'Trans proline' 0 C--N 1.35 0.612 0 C-N-CA 121.518 1.478 . . . . 0.0 109.359 176.113 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 198' ' ' TYR . . . . . 0.595 ' H ' ' C ' ' B' ' 196' ' ' THR . 1.1 t80 . . . . . 0 C--O 1.248 0.976 0 CA-C-N 114.12 -1.4 . . . . 0.0 111.289 -178.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . 0.495 ' O ' ' HB ' ' A' ' 2' ' ' VAL . 0.1 OUTLIER . . . . . 0 N--CA 1.485 1.309 0 CA-C-O 120.466 0.174 . . . . 0.0 110.812 . . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . 0.675 ' HA ' ' HA ' ' A' ' 15' ' ' THR . 4.0 p 147.44 138.08 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 C-N-CA 123.461 0.705 . . . . 0.0 110.439 179.388 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.487 ' O ' ' C ' ' A' ' 4' ' ' HIS . 0.5 OUTLIER -160.08 54.01 0.34 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.68 -179.719 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . 0.487 ' C ' ' O ' ' A' ' 3' ' ' CYS . 4.9 p-80 -23.7 110.31 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 122.659 0.384 . . . . 0.0 112.033 179.627 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.411 ' CG2' ' N ' ' A' ' 13' ' ' ALA . 2.6 t -44.82 149.86 0.4 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.07 -0.513 . . . . 0.0 111.319 -179.642 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 16.8 p -81.01 2.34 27.41 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.448 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -58.19 88.69 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.727 0.299 . . . . 0.0 111.205 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 1.2 p 71.1 173.7 0.31 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.049 0.452 . . . . 0.0 111.206 179.55 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.495 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 6.0 t -58.8 -58.91 15.79 Favored Pre-proline 0 C--N 1.33 -0.283 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.752 -179.695 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.495 ' HD2' ' N ' ' A' ' 9' ' ' SER . 9.5 Cg_endo -52.01 -93.27 0.0 OUTLIER 'Trans proline' 0 CA--C 1.534 0.495 0 C-N-CA 122.505 2.137 . . . . 0.0 112.652 -179.168 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.451 ' CG2' ' O ' ' A' ' 10' ' ' PRO . 0.2 OUTLIER 170.9 176.66 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.277 0 CA-C-O 120.664 0.269 . . . . 0.0 110.742 -179.797 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -177.09 17.24 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 179.669 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.411 ' N ' ' CG2' ' A' ' 5' ' ' THR . . . 168.54 66.03 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.756 0.312 . . . . 0.0 111.741 179.814 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.449 HG22 ' N ' ' A' ' 4' ' ' HIS . 6.9 p -89.95 165.11 2.05 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.584 179.627 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.675 ' HA ' ' HA ' ' A' ' 2' ' ' VAL . 2.1 p 85.57 106.68 0.05 OUTLIER 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 122.962 0.505 . . . . 0.0 110.961 -179.684 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.46 ' N ' ' HD3' ' A' ' 17' ' ' PRO . 46.5 t -133.83 59.45 39.17 Favored Pre-proline 0 CA--C 1.533 0.294 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.721 -179.905 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.518 ' CB ' ' HD3' ' A' ' 18' ' ' PRO . 10.5 Cg_exo -66.79 -55.49 0.33 Allowed 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 122.058 1.839 . . . . 0.0 112.98 179.996 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.518 ' HD3' ' CB ' ' A' ' 17' ' ' PRO . 43.4 Cg_endo -97.16 -166.5 0.1 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.77 0 C-N-CA 122.818 2.345 . . . . 0.0 112.795 -179.4 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 78.33 -65.4 3.37 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.801 179.48 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -113.32 156.42 23.4 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.978 0.418 . . . . 0.0 111.207 -179.577 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.434 ' O ' ' CD1' ' A' ' 22' ' ' LEU . 0.2 OUTLIER -103.3 40.21 1.44 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.62 179.871 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.434 ' CD1' ' O ' ' A' ' 21' ' ' ASN . 0.6 OUTLIER 165.82 -172.99 0.02 OUTLIER 'General case' 0 N--CA 1.461 0.121 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.033 -179.692 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.541 ' HB2' ' C ' ' A' ' 60' ' ' CYS . 1.6 m -120.32 88.55 2.96 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.429 0.633 . . . . 0.0 111.292 -179.835 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.507 ' O ' ' N ' ' A' ' 44' ' ' CYS . 14.7 t80 -78.51 125.38 29.29 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.063 -0.971 . . . . 0.0 112.201 -179.254 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.404 ' HA ' ' HB3' ' A' ' 42' ' ' LEU . 0.0 OUTLIER -155.97 137.72 14.29 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.651 -0.25 . . . . 0.0 110.653 179.263 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.469 ' HA ' ' O ' ' A' ' 56' ' ' GLU . 4.5 mttt -80.04 145.25 32.58 Favored 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 120.901 -0.32 . . . . 0.0 110.922 -179.831 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 50.1 tpp -153.49 146.05 24.14 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.332 -179.783 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' TRP . . . . . 0.445 ' O ' ' CB ' ' A' ' 29' ' ' CYS . 0.3 OUTLIER -149.04 -160.54 1.19 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.768 179.88 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . 0.631 ' HA ' ' HB3' ' A' ' 33' ' ' CYS . 0.1 OUTLIER 85.68 -17.6 0.4 Allowed 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 122.806 0.442 . . . . 0.0 111.724 -179.921 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 41.1 m-20 -54.19 126.73 24.05 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.776 0.322 . . . . 0.0 110.978 -179.91 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . 67.28 -72.29 0.09 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.878 -179.793 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.452 ' O ' ' SG ' ' A' ' 33' ' ' CYS . 18.6 m-85 -71.63 -164.24 0.12 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.34 179.647 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.631 ' HB3' ' HA ' ' A' ' 29' ' ' CYS . 0.5 OUTLIER 74.51 -50.12 0.67 Allowed 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 112.094 0.405 . . . . 0.0 112.094 179.554 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.402 ' N ' ' SG ' ' A' ' 33' ' ' CYS . 0.3 OUTLIER 53.73 55.6 8.28 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.871 0.367 . . . . 0.0 110.685 -179.854 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 67.28 35.2 4.5 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.14 -179.811 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -144.71 12.8 1.49 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.866 -179.909 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.431 ' N ' ' HB2' ' A' ' 33' ' ' CYS . . . -87.7 -52.39 3.0 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.647 -0.787 . . . . 0.0 112.862 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.483 ' HG3' ' HB3' ' B' ' 190' ' ' TYR . 0.0 OUTLIER 36.47 74.91 0.07 Allowed 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 120.839 0.352 . . . . 0.0 111.111 -179.677 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 18.9 t -118.64 124.81 73.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 121.174 0.511 . . . . 0.0 111.917 -179.082 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 27.1 m -158.3 159.37 2.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.838 179.31 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.422 ' CG ' ' HB2' ' A' ' 26' ' ' LYS . 0.1 OUTLIER 175.52 -87.15 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.936 0.717 . . . . 0.0 112.936 -179.656 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.405 HD13 ' CG ' ' A' ' 26' ' ' LYS . 0.3 OUTLIER -51.77 -175.75 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.14 0 N-CA-C 112.88 0.696 . . . . 0.0 112.88 -177.761 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 166.59 93.84 0.09 OUTLIER Glycine 0 N--CA 1.448 -0.554 0 N-CA-C 110.165 -1.174 . . . . 0.0 110.165 -179.209 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.507 ' N ' ' O ' ' A' ' 24' ' ' TYR . 0.1 OUTLIER 76.57 109.29 0.08 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.041 0.448 . . . . 0.0 110.49 -178.155 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.551 ' O ' ' N ' ' A' ' 47' ' ' THR . . . -173.5 147.11 1.42 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.137 -179.668 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.474 ' O ' ' CB ' ' A' ' 47' ' ' THR . . . 47.33 -82.43 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.709 179.394 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.551 ' N ' ' O ' ' A' ' 45' ' ' ALA . 1.2 t 156.76 62.19 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.402 179.821 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.497 ' N ' ' HD3' ' A' ' 49' ' ' PRO . 49.6 t 43.91 53.51 10.41 Favored Pre-proline 0 N--CA 1.466 0.375 0 N-CA-C 111.787 0.292 . . . . 0.0 111.787 179.688 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.497 ' HD3' ' N ' ' A' ' 48' ' ' CYS . 37.4 Cg_exo -55.0 -25.45 44.6 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 121.984 1.789 . . . . 0.0 111.002 179.088 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 3.0 t -55.78 179.95 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.206 -0.906 . . . . 0.0 111.323 179.751 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 11.8 ptpt 175.89 -47.72 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.035 179.881 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.419 ' HB2' ' CE2' ' A' ' 54' ' ' TYR . 0.0 OUTLIER -75.02 149.27 85.08 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.974 -179.898 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -59.32 -47.66 16.34 Favored 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.59 2.194 . . . . 0.0 112.364 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . 0.419 ' CE2' ' HB2' ' A' ' 52' ' ' LYS . 0.0 OUTLIER -64.49 75.91 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.996 -179.751 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -152.27 -160.36 1.13 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.161 -179.877 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.469 ' O ' ' HA ' ' A' ' 26' ' ' LYS . 17.9 tt0 -148.87 21.28 1.0 Allowed 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 120.525 0.202 . . . . 0.0 110.604 179.452 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.445 ' HA ' ' HA ' ' A' ' 26' ' ' LYS . 4.8 m -145.61 -174.12 0.47 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.106 0 CA-C-O 120.891 0.376 . . . . 0.0 110.989 179.63 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 8.9 t 178.39 -170.28 0.1 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.425 179.569 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . 0.41 ' HB3' HD23 ' A' ' 22' ' ' LEU . 0.0 OUTLIER -101.29 134.78 43.82 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.872 0.367 . . . . 0.0 110.292 179.681 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.541 ' C ' ' HB2' ' A' ' 23' ' ' CYS . 0.5 OUTLIER -123.45 15.68 9.65 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.448 -179.418 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.526 ' N ' ' HB2' ' A' ' 23' ' ' CYS . 0.3 OUTLIER -64.94 95.16 0.15 Allowed 'General case' 0 C--N 1.333 -0.116 0 CA-C-O 121.057 0.456 . . . . 0.0 111.289 -179.123 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER 168.39 67.81 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.377 179.826 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . 0.404 ' HA ' ' CG1' ' A' ' 2' ' ' VAL . 1.2 t0 64.81 -163.91 0.25 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.551 -179.737 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.402 ' HB3' ' CE1' ' A' ' 4' ' ' HIS . 0.0 OUTLIER -60.74 87.59 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.88 0.371 . . . . 0.0 110.306 179.864 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 16.7 t -94.95 -50.01 5.3 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.941 -179.735 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 29.4 m-20 -43.29 100.47 0.23 Allowed Pre-proline 0 N--CA 1.463 0.201 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.533 -179.761 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -90.89 131.57 1.53 Allowed 'Trans proline' 0 N--CA 1.454 -0.797 0 C-N-CA 122.732 2.288 . . . . 0.0 112.059 -180.0 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 5.7 p80 -48.0 161.49 0.36 Allowed Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.726 179.83 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . 0.483 ' HG2' ' CB ' ' B' ' 191' ' ' THR . 75.3 Cg_exo -47.21 173.07 0.03 OUTLIER 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.429 2.086 . . . . 0.0 112.083 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.436 ' O ' ' C ' ' A' ' 71' ' ' GLN . 0.0 OUTLIER -54.47 -27.35 36.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.034 -179.817 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.436 ' C ' ' O ' ' A' ' 70' ' ' LYS . 22.8 tp60 25.42 -91.15 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.487 0 O-C-N 123.571 0.544 . . . . 0.0 112.388 179.78 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.507 ' HB2' ' HD3' ' A' ' 73' ' ' PRO . 0.0 OUTLIER -96.2 -53.13 0.22 Allowed Pre-proline 0 CA--C 1.528 0.128 0 CA-C-O 120.47 0.176 . . . . 0.0 110.762 179.767 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.507 ' HD3' ' HB2' ' A' ' 72' ' ' ARG . 15.5 Cg_exo -68.67 113.32 3.14 Favored 'Trans proline' 0 C--N 1.349 0.559 0 C-N-CA 122.42 2.08 . . . . 0.0 112.162 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.088 0 CA-C-O 118.313 -1.27 . . . . 0.0 112.521 -179.937 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 181' ' ' TYR . . . . . . . . . . . . . 9.5 p90 . . . . . 0 N--CA 1.486 1.351 0 CA-C-O 120.562 0.22 . . . . 0.0 111.059 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 182' ' ' ARG . . . . . . . . . . . . . 1.6 mtp85 68.61 30.95 4.89 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.891 0.376 . . . . 0.0 110.656 -179.835 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 183' ' ' GLY . . . . . . . . . . . . . . . -150.84 53.53 0.49 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.896 -0.668 . . . . 0.0 112.3 179.883 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 184' ' ' TRP . . . . . . . . . . . . . 16.4 m95 -91.7 12.68 20.42 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.75 0.31 . . . . 0.0 111.465 -179.809 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 185' ' ' LYS . . . . . . . . . . . . . 38.4 tttt -49.68 128.65 18.31 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.931 0.396 . . . . 0.0 111.215 -179.825 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 186' ' ' HIS . . . . . . . . . . . . . 9.5 t-160 -119.7 78.92 1.37 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.77 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 187' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -84.76 -172.5 4.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.044 -179.884 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -90.83 -169.93 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.24 -179.654 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 189' ' ' TYR . . . . . 0.405 ' CE1' ' OE1' ' A' ' 41' ' ' GLU . 0.7 OUTLIER -119.98 58.7 0.9 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.013 -179.729 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 190' ' ' TYR . . . . . 0.483 ' HB3' ' HG3' ' A' ' 38' ' ' LYS . 2.4 p90 -79.74 174.0 12.03 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.045 -179.832 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 191' ' ' THR . . . . . 0.483 ' CB ' ' HG2' ' A' ' 69' ' ' PRO . 0.6 OUTLIER -42.88 142.11 0.97 Allowed 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.292 179.729 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 192' ' ' CYS . . . . . 0.704 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.0 OUTLIER -90.13 168.66 11.8 Favored 'General case' 0 CA--C 1.498 -1.036 0 CA-C-O 121.959 0.885 . . . . 0.0 111.467 179.687 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 193' ' ' CYS . . . . . 0.704 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.1 OUTLIER 44.67 178.26 0.0 OUTLIER Pre-proline 0 C--N 1.314 -0.972 0 CA-C-N 113.048 -1.887 . . . . 0.0 112.954 173.622 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 194' ' ' PRO . . . . . 0.401 ' HD2' ' HB2' ' B' ' 193' ' ' CYS . 95.2 Cg_endo -86.75 -178.62 2.68 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.815 2.343 . . . . 0.0 112.706 -179.469 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -116.09 -69.48 0.85 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.296 -179.858 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 196' ' ' THR . . . . . 0.612 ' C ' ' H ' ' B' ' 198' ' ' TYR . 12.8 t -143.05 40.79 0.34 Allowed Pre-proline 0 C--N 1.33 -0.256 0 N-CA-C 112.376 0.509 . . . . 0.0 112.376 -179.449 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 197' ' ' PRO . . . . . 0.526 ' CD ' ' N ' ' B' ' 196' ' ' THR . 73.8 Cg_endo -74.38 17.79 0.51 Allowed 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 121.52 1.48 . . . . 0.0 108.987 175.953 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 198' ' ' TYR . . . . . 0.612 ' H ' ' C ' ' B' ' 196' ' ' THR . 77.9 t80 . . . . . 0 C--O 1.249 1.079 0 CA-C-N 113.994 -1.457 . . . . 0.0 111.272 -178.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . 0.416 ' CG2' ' HA ' ' A' ' 62' ' ' THR . 27.2 mm . . . . . 0 N--CA 1.487 1.375 0 CA-C-O 120.899 0.38 . . . . 0.0 111.09 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . 0.422 HG12 ' CG2' ' A' ' 14' ' ' VAL . 1.1 p -174.98 178.81 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.033 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -127.0 92.23 3.49 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 120.636 0.255 . . . . 0.0 111.656 -179.527 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . 0.546 ' HA ' HG13 ' A' ' 14' ' ' VAL . 75.0 m80 -39.58 147.22 0.08 Allowed 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.902 179.816 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 18.9 p -71.9 79.89 0.9 Allowed 'General case' 0 C--N 1.334 -0.085 0 CA-C-O 120.902 0.382 . . . . 0.0 111.411 -179.467 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 4.7 p 63.31 7.48 2.91 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.734 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.424 ' O ' ' C ' ' A' ' 8' ' ' THR . . . 73.83 -55.62 0.66 Allowed 'General case' 0 N--CA 1.462 0.174 0 N-CA-C 111.909 0.336 . . . . 0.0 111.909 179.506 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.424 ' C ' ' O ' ' A' ' 7' ' ' ALA . 33.9 p -30.03 130.19 0.09 Allowed 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 -179.539 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.425 ' HB3' ' HD2' ' A' ' 10' ' ' PRO . 0.5 OUTLIER 68.22 167.25 0.12 Allowed Pre-proline 0 C--N 1.331 -0.22 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.519 -179.771 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.438 ' O ' HG12 ' A' ' 11' ' ' ILE . 28.0 Cg_endo -60.57 -34.03 92.95 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.581 2.187 . . . . 0.0 111.795 179.759 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.438 HG12 ' O ' ' A' ' 10' ' ' PRO . 0.1 OUTLIER 47.86 -160.63 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.85 179.598 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.416 ' O ' HG11 ' A' ' 14' ' ' VAL . 1.5 p 170.11 -64.4 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 120.833 0.349 . . . . 0.0 110.591 -179.568 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.3 81.79 0.09 Allowed 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 179.234 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.546 HG13 ' HA ' ' A' ' 4' ' ' HIS . 0.8 OUTLIER -127.7 151.32 34.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.289 -178.669 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.454 ' CB ' ' O ' ' A' ' 14' ' ' VAL . 0.1 OUTLIER 160.4 82.01 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.158 179.317 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.534 ' HB2' ' HD2' ' A' ' 17' ' ' PRO . 0.8 OUTLIER -63.03 179.31 0.31 Allowed Pre-proline 0 CA--C 1.532 0.264 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 179.113 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.534 ' HD2' ' HB2' ' A' ' 16' ' ' CYS . 28.8 Cg_exo -33.81 114.25 0.08 OUTLIER 'Trans proline' 0 C--N 1.35 0.617 0 C-N-CA 122.662 2.241 . . . . 0.0 113.144 -179.208 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_exo -46.09 177.79 0.01 OUTLIER 'Trans proline' 0 C--N 1.35 0.608 0 C-N-CA 123.196 2.598 . . . . 0.0 113.33 -179.168 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 69.39 -158.72 53.23 Favored Glycine 0 N--CA 1.451 -0.345 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.981 -179.729 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -57.96 -166.18 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 110.209 -0.293 . . . . 0.0 110.209 179.424 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.488 ' HB2' ' N ' ' A' ' 46' ' ' ALA . 0.0 OUTLIER 66.23 90.38 0.09 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.186 0.517 . . . . 0.0 109.724 -179.899 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.525 ' HB3' ' HB3' ' A' ' 60' ' ' CYS . 0.7 OUTLIER -112.52 178.12 4.4 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.315 0.578 . . . . 0.0 112.13 -178.9 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.563 ' O ' ' HB2' ' A' ' 60' ' ' CYS . 12.7 m -62.62 84.94 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.264 -0.88 . . . . 0.0 112.877 -178.278 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.491 ' HB3' ' HA ' ' A' ' 59' ' ' CYS . 40.0 p90 -68.09 70.24 0.15 Allowed 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.507 0.67 . . . . 0.0 109.298 178.153 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.423 ' N ' ' O ' ' A' ' 23' ' ' CYS . 0.0 OUTLIER -41.15 147.1 0.15 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.11 -0.95 . . . . 0.0 112.948 -178.347 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -130.48 171.89 12.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 114.974 -1.012 . . . . 0.0 109.547 179.065 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 2.3 ttp -160.53 -176.55 5.64 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.916 0.389 . . . . 0.0 111.574 -179.776 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' TRP . . . . . 0.494 ' HB2' ' CG2' ' A' ' 39' ' ' VAL . 0.4 OUTLIER -100.3 -164.35 1.11 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.246 -179.948 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER 69.7 -65.37 0.31 Allowed 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.809 -179.935 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 61.97 78.51 0.29 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.25 179.659 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . 48.89 45.01 22.53 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.447 179.631 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -152.23 -170.56 3.68 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.688 179.862 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 44.89 -170.76 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.448 179.822 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 47.7 t -89.58 -28.56 19.48 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.472 179.636 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.461 ' O ' ' N ' ' A' ' 37' ' ' GLY . 1.3 p -179.74 -49.58 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.796 179.814 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 30.87 -87.22 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.329 0.652 . . . . 0.0 112.496 179.614 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.461 ' N ' ' O ' ' A' ' 35' ' ' SER . . . 62.05 -105.76 1.03 Allowed Glycine 0 C--N 1.332 0.347 0 C-N-CA 120.508 -0.853 . . . . 0.0 112.781 179.795 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.438 ' CE ' ' HB3' ' A' ' 69' ' ' PRO . 0.4 OUTLIER 45.26 43.6 8.26 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 121.174 0.511 . . . . 0.0 111.745 179.944 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.494 ' CG2' ' HB2' ' A' ' 28' ' ' TRP . 3.3 t -137.68 105.46 3.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.136 178.656 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.407 ' CG1' ' HB ' ' B' ' 191' ' ' THR . 12.1 p -110.83 163.4 7.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-O 121.231 0.538 . . . . 0.0 112.354 -178.198 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.491 ' CD ' ' N ' ' A' ' 41' ' ' GLU . 0.3 OUTLIER -164.66 -123.71 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.408 -179.975 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -169.79 -57.24 0.02 OUTLIER 'General case' 0 C--O 1.233 0.188 0 CA-C-N 118.101 0.41 . . . . 0.0 110.976 179.314 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.475 ' C ' ' CE1' ' A' ' 24' ' ' TYR . . . 96.35 -109.66 3.89 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.746 -0.74 . . . . 0.0 113.108 179.673 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.503 ' HA ' ' O ' ' A' ' 22' ' ' LEU . 52.5 t 74.72 88.01 0.09 Allowed 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.998 0.427 . . . . 0.0 110.503 -178.94 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.436 ' HB2' ' CE1' ' A' ' 24' ' ' TYR . . . -164.68 146.37 8.18 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.729 -0.668 . . . . 0.0 111.12 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.488 ' N ' ' HB2' ' A' ' 21' ' ' ASN . . . -121.64 76.99 1.31 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.089 -179.796 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.456 ' CG2' ' HD3' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -172.49 -38.82 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.008 -179.888 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.414 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 5.7 m 59.41 52.32 3.78 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.396 179.532 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.456 ' HD3' ' CG2' ' A' ' 47' ' ' THR . 59.6 Cg_endo -71.97 -9.82 25.22 Favored 'Trans proline' 0 C--N 1.343 0.266 0 C-N-CA 122.315 2.01 . . . . 0.0 111.578 179.004 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 6.8 t -55.51 140.45 40.46 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.143 179.797 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -168.26 33.66 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.678 179.899 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.411 ' HB3' ' HD2' ' A' ' 53' ' ' PRO . 1.4 mttm -81.98 158.48 67.39 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.668 -179.887 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . 0.411 ' HD2' ' HB3' ' A' ' 52' ' ' LYS . 12.7 Cg_endo -56.35 -70.48 0.04 OUTLIER 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.527 2.151 . . . . 0.0 112.13 179.93 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -70.76 -80.55 0.05 Allowed 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.132 -179.906 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 42.24 -155.26 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.575 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.5 tp10 -175.05 -38.26 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.347 0 CA-C-O 120.687 0.279 . . . . 0.0 111.297 -179.341 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 29.5 m -49.36 149.92 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.993 0.425 . . . . 0.0 111.785 -179.545 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 3.8 t -147.55 20.42 1.18 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.876 179.651 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . 0.491 ' HA ' ' HB3' ' A' ' 24' ' ' TYR . 1.3 m 62.1 124.09 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.975 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.563 ' HB2' ' O ' ' A' ' 23' ' ' CYS . 4.6 t -84.91 -52.65 5.85 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.103 -179.679 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 53.09 99.62 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.314 179.646 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' THR . . . . . 0.416 ' HA ' ' CG2' ' A' ' 1' ' ' ILE . 46.7 p 40.69 96.66 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.902 179.689 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . 0.44 ' O ' ' CG ' ' A' ' 64' ' ' LYS . 1.0 OUTLIER 178.26 -13.14 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 179.634 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.473 ' O ' ' C ' ' A' ' 65' ' ' CYS . 3.8 ptmm? 46.65 31.75 1.48 Allowed 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 120.742 0.306 . . . . 0.0 110.839 -179.405 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . 0.473 ' C ' ' O ' ' A' ' 64' ' ' LYS . 0.1 OUTLIER -17.0 -65.36 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 115.459 -0.791 . . . . 0.0 112.674 -179.757 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.494 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 4.8 t-20 76.5 92.21 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.307 -179.848 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 12.8 Cg_exo -69.4 -171.62 0.46 Allowed 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.759 2.306 . . . . 0.0 112.109 179.83 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 7.4 p80 176.71 158.57 0.46 Allowed Pre-proline 0 C--N 1.331 -0.224 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.839 179.805 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . 0.513 ' HG3' HG23 ' B' ' 191' ' ' THR . 45.1 Cg_exo -55.57 136.35 73.63 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.509 2.139 . . . . 0.0 112.139 179.908 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.403 ' HB3' ' H ' ' A' ' 38' ' ' LYS . 0.4 OUTLIER -92.79 -50.62 5.48 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.44 179.812 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 42.4 tp60 -77.81 55.5 1.39 Allowed 'General case' 0 C--O 1.232 0.175 0 CA-C-O 120.846 0.355 . . . . 0.0 111.004 179.763 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.603 ' N ' ' CD ' ' A' ' 73' ' ' PRO . 1.3 ptp180 -93.89 -30.33 0.29 Allowed Pre-proline 0 CA--C 1.536 0.438 0 N-CA-C 112.551 0.575 . . . . 0.0 112.551 -179.682 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.603 ' CD ' ' N ' ' A' ' 72' ' ' ARG . 89.3 Cg_endo -83.57 99.52 0.84 Allowed 'Trans proline' 0 C--N 1.35 0.636 0 C-N-CA 121.961 1.774 . . . . 0.0 112.41 -179.738 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.367 -1.241 . . . . 0.0 112.5 -179.995 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 181' ' ' TYR . . . . . 0.428 ' O ' ' HB3' ' B' ' 182' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.584 0 N-CA-C 111.367 0.136 . . . . 0.0 111.367 . . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 182' ' ' ARG . . . . . 0.428 ' HB3' ' O ' ' B' ' 181' ' ' TYR . 14.7 tpt180 69.58 -65.35 0.31 Allowed 'General case' 0 C--O 1.232 0.158 0 CA-C-O 120.688 0.28 . . . . 0.0 110.816 -179.729 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 183' ' ' GLY . . . . . . . . . . . . . . . -64.43 145.09 49.29 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.34 179.88 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 184' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -118.24 -39.31 3.06 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.758 0.313 . . . . 0.0 110.971 -179.834 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 185' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -120.59 158.02 28.26 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.072 -179.859 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 186' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -146.43 -164.39 1.96 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.649 179.892 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 187' ' ' TRP . . . . . . . . . . . . . 34.4 m95 -75.69 159.11 31.48 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.922 0.391 . . . . 0.0 111.0 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 188' ' ' VAL . . . . . 0.417 ' CG2' ' N ' ' B' ' 189' ' ' TYR . 0.2 OUTLIER -80.3 -81.32 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.68 179.913 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 189' ' ' TYR . . . . . 0.417 ' N ' ' CG2' ' B' ' 188' ' ' VAL . 1.7 m-85 -130.06 126.96 38.9 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.782 0.325 . . . . 0.0 110.367 179.675 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 190' ' ' TYR . . . . . 0.429 ' CZ ' ' HE3' ' A' ' 38' ' ' LYS . 0.3 OUTLIER -138.28 115.99 11.42 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.154 0.502 . . . . 0.0 111.359 -179.542 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 191' ' ' THR . . . . . 0.513 HG23 ' HG3' ' A' ' 69' ' ' PRO . 1.0 OUTLIER -90.61 44.31 1.19 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.565 179.201 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 192' ' ' CYS . . . . . 0.697 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.0 OUTLIER -52.72 172.37 0.05 OUTLIER 'General case' 0 CA--C 1.497 -1.073 0 CA-C-O 121.884 0.85 . . . . 0.0 111.587 -179.872 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 193' ' ' CYS . . . . . 0.697 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.1 OUTLIER 43.14 81.65 0.24 Allowed Pre-proline 0 N--CA 1.439 -1.003 0 CA-C-N 113.452 -1.704 . . . . 0.0 112.161 173.75 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 194' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -86.44 30.67 0.48 Allowed 'Trans proline' 0 N--CA 1.461 -0.384 0 C-N-CA 123.054 2.503 . . . . 0.0 112.781 -179.878 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -162.45 71.57 0.32 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.876 0.369 . . . . 0.0 110.664 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 196' ' ' THR . . . . . 0.643 ' N ' ' HD3' ' B' ' 197' ' ' PRO . 65.2 p -143.36 47.93 0.88 Allowed Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.871 -179.875 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 197' ' ' PRO . . . . . 0.643 ' HD3' ' N ' ' B' ' 196' ' ' THR . 6.3 Cg_exo -73.95 13.5 0.8 Allowed 'Trans proline' 0 C--N 1.351 0.683 0 C-N-CA 121.674 1.583 . . . . 0.0 108.742 175.941 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 198' ' ' TYR . . . . . 0.614 ' H ' ' C ' ' B' ' 196' ' ' THR . 63.9 t80 . . . . . 0 C--O 1.249 1.049 0 CA-C-N 113.929 -1.487 . . . . 0.0 111.291 -178.803 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 2.1 tp . . . . . 0 N--CA 1.486 1.37 0 CA-C-O 120.593 0.235 . . . . 0.0 111.1 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . 0.412 HG21 ' HA ' ' A' ' 15' ' ' THR . 0.5 OUTLIER -178.97 -169.04 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.566 -0.288 . . . . 0.0 110.792 -179.933 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.501 ' O ' ' CD2' ' A' ' 4' ' ' HIS . 0.9 OUTLIER -147.16 -50.26 0.19 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.712 0.291 . . . . 0.0 111.302 179.971 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . 0.501 ' CD2' ' O ' ' A' ' 3' ' ' CYS . 3.4 p80 53.95 110.28 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.244 0.545 . . . . 0.0 111.029 -179.591 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.473 ' O ' ' HA ' ' A' ' 10' ' ' PRO . 1.9 t -82.7 109.95 17.33 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.552 -179.029 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.403 ' OG1' ' CE1' ' A' ' 4' ' ' HIS . 4.0 m -93.55 17.77 11.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.356 179.659 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -59.76 84.78 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.785 0.326 . . . . 0.0 110.93 179.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 2.2 p 60.44 19.07 8.78 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.896 -179.711 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 2.5 p 168.8 104.29 0.04 OUTLIER Pre-proline 0 C--O 1.232 0.137 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.823 -179.914 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.517 ' C ' ' H ' ' A' ' 12' ' ' SER . 23.3 Cg_endo -85.69 -136.34 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.704 2.269 . . . . 0.0 111.45 179.804 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.403 ' CG2' ' O ' ' A' ' 10' ' ' PRO . 1.3 tt 55.27 0.08 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.286 0 N-CA-C 113.126 0.787 . . . . 0.0 113.126 179.616 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.517 ' H ' ' C ' ' A' ' 10' ' ' PRO . 0.1 OUTLIER -67.89 -43.74 78.62 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.761 0.315 . . . . 0.0 111.297 -179.504 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 58.99 44.42 16.36 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.005 0.431 . . . . 0.0 110.767 -179.639 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 16.1 m -54.01 -39.13 39.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.366 -179.803 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.412 ' HA ' HG21 ' A' ' 2' ' ' VAL . 1.8 p 62.71 147.76 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.893 -179.924 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 6.8 t -128.53 57.63 29.68 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.599 -179.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.601 ' N ' ' HD2' ' A' ' 18' ' ' PRO . 74.2 Cg_exo -47.0 -50.06 11.55 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.656 2.238 . . . . 0.0 112.981 179.592 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.601 ' HD2' ' N ' ' A' ' 17' ' ' PRO . 11.2 Cg_endo -55.37 -62.14 0.3 Allowed 'Trans proline' 0 C--N 1.349 0.575 0 C-N-CA 122.345 2.03 . . . . 0.0 112.498 -179.649 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.478 ' HA2' ' HA ' ' A' ' 46' ' ' ALA . . . -45.99 156.7 0.45 Allowed Glycine 0 C--N 1.331 0.25 0 C-N-CA 120.823 -0.703 . . . . 0.0 112.459 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.467 ' HG3' ' CD1' ' A' ' 22' ' ' LEU . 0.0 OUTLIER -99.4 48.96 0.94 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.031 0.444 . . . . 0.0 112.128 -179.314 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 77.72 60.52 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.744 -0.662 . . . . 0.0 112.441 178.357 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.477 ' CD2' ' O ' ' A' ' 22' ' ' LEU . 0.0 OUTLIER -152.13 96.7 2.22 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 121.003 0.43 . . . . 0.0 111.605 178.366 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.542 ' HA ' ' HA ' ' A' ' 44' ' ' CYS . 9.5 m -87.77 44.81 1.22 Allowed 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.825 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.605 ' O ' ' CB ' ' A' ' 25' ' ' ARG . 0.2 OUTLIER 35.29 -89.31 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 179.535 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.605 ' CB ' ' O ' ' A' ' 24' ' ' TYR . 12.5 ttm-85 107.08 -59.69 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.331 0.652 . . . . 0.0 111.835 -179.959 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.457 ' CB ' ' CB ' ' A' ' 41' ' ' GLU . 0.7 OUTLIER 61.53 123.89 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.541 -179.048 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 10.0 ptt? -144.41 137.59 27.13 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.003 0.43 . . . . 0.0 111.87 -179.65 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' TRP . . . . . 0.407 ' HB3' ' CG2' ' A' ' 39' ' ' VAL . 4.3 t90 -136.41 142.54 43.69 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.426 179.399 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . 0.465 ' HA ' ' CB ' ' A' ' 33' ' ' CYS . 33.8 t 69.94 11.13 7.67 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.51 -179.822 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -97.97 44.82 1.03 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.778 0.323 . . . . 0.0 111.072 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -178.3 -88.32 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.983 179.753 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -96.63 76.47 2.85 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.996 0.427 . . . . 0.0 110.077 179.526 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.465 ' CB ' ' HA ' ' A' ' 29' ' ' CYS . 7.2 t -161.15 156.49 24.43 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.798 -179.119 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -51.35 -54.3 27.73 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.96 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 2.6 m -86.43 168.29 13.91 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.614 179.755 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.419 ' CG ' ' O ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -100.51 63.12 1.08 Allowed 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.363 -179.637 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.446 ' N ' ' O ' ' A' ' 29' ' ' CYS . . . 78.46 144.26 2.47 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.436 -0.887 . . . . 0.0 113.118 179.498 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.595 ' HA ' ' HG2' ' A' ' 70' ' ' LYS . 0.0 OUTLIER 179.19 33.25 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.333 0.587 . . . . 0.0 109.83 179.574 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.407 ' CG2' ' HB3' ' A' ' 28' ' ' TRP . 46.2 t -143.27 134.54 23.22 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-N 115.295 -0.866 . . . . 0.0 110.128 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.405 HG21 ' HB2' ' A' ' 69' ' ' PRO . 0.1 OUTLIER -144.99 159.76 13.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 120.922 0.392 . . . . 0.0 111.328 -179.334 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.457 ' CB ' ' CB ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -157.19 42.81 0.34 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.12 -179.999 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.401 ' CD2' HG11 ' A' ' 40' ' ' VAL . 4.2 mm? -51.19 153.03 2.13 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.571 179.721 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 158.87 -6.04 0.14 Allowed Glycine 0 CA--C 1.52 0.345 0 C-N-CA 120.1 -1.048 . . . . 0.0 113.74 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.542 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 52.5 t 61.32 152.88 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 117.602 0.701 . . . . 0.0 111.496 179.752 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.457 ' CB ' ' CE1' ' A' ' 24' ' ' TYR . . . -128.06 -79.37 0.58 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.743 179.745 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.478 ' HA ' ' HA2' ' A' ' 19' ' ' GLY . . . 168.01 -24.98 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.874 179.699 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 14.8 t -146.1 134.19 21.55 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.766 0.317 . . . . 0.0 111.438 -179.449 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.489 ' O ' ' N ' ' A' ' 50' ' ' SER . 11.3 m -78.99 -47.11 1.69 Allowed Pre-proline 0 C--N 1.333 -0.142 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.732 179.552 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.473 ' CD ' ' N ' ' A' ' 48' ' ' CYS . 17.3 Cg_exo -65.97 59.76 0.44 Allowed 'Trans proline' 0 C--N 1.349 0.585 0 C-N-CA 122.335 2.024 . . . . 0.0 110.374 178.701 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.489 ' N ' ' O ' ' A' ' 48' ' ' CYS . 23.0 t -93.65 -41.23 9.83 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 115.231 -0.895 . . . . 0.0 111.018 -178.615 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.528 ' O ' ' CB ' ' A' ' 52' ' ' LYS . 4.3 mmtm -141.47 -80.12 0.25 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.712 179.747 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.688 ' HB2' ' HD3' ' A' ' 53' ' ' PRO . 4.9 mtpp 107.29 -56.92 0.0 OUTLIER Pre-proline 0 N--CA 1.474 0.759 0 C-N-CA 123.954 0.902 . . . . 0.0 111.355 179.735 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . 0.688 ' HD3' ' HB2' ' A' ' 52' ' ' LYS . 39.4 Cg_exo -59.83 -156.65 0.02 OUTLIER 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 122.06 1.84 . . . . 0.0 111.971 179.641 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.84 85.59 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.598 179.691 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 13.1 tt0 -106.9 -91.14 0.42 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.256 -179.704 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 174.59 -50.18 0.01 OUTLIER 'General case' 0 N--CA 1.456 -0.141 0 CA-C-O 121.004 0.431 . . . . 0.0 110.47 -179.509 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.455 ' HA ' ' HA ' ' A' ' 26' ' ' LYS . 30.1 m -92.54 178.24 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 115.844 -0.617 . . . . 0.0 111.554 -179.644 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -167.3 33.6 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.441 179.88 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 2.7 m 68.99 168.04 0.28 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.581 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.445 ' HB3' ' HB2' ' A' ' 23' ' ' CYS . 0.1 OUTLIER -162.18 36.14 0.12 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.742 0.306 . . . . 0.0 111.495 -179.374 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.72 -163.0 0.18 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.655 0.264 . . . . 0.0 111.222 -179.916 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 1.4 p 77.71 27.99 0.58 Allowed 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.224 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 16.2 t70 60.68 149.66 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.572 179.288 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 29.53 87.39 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 115.631 -0.713 . . . . 0.0 112.517 179.57 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . 0.432 ' CB ' ' O ' ' A' ' 60' ' ' CYS . 49.0 t -123.4 -10.49 7.97 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.297 179.77 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.532 ' N ' ' HD2' ' A' ' 67' ' ' PRO . 12.3 m-80 -63.07 -57.06 22.87 Favored Pre-proline 0 CA--C 1.531 0.236 0 CA-C-N 116.578 -0.283 . . . . 0.0 111.534 -179.913 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . 0.532 ' HD2' ' N ' ' A' ' 66' ' ' ASN . 1.3 Cg_endo -42.83 165.4 0.03 OUTLIER 'Trans proline' 0 C--N 1.349 0.58 0 C-N-CA 122.992 2.461 . . . . 0.0 112.94 -179.65 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.499 ' N ' ' HD3' ' A' ' 69' ' ' PRO . 2.2 m-70 57.57 51.81 5.08 Favored Pre-proline 0 C--N 1.331 -0.197 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.064 -179.801 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . 0.499 ' HD3' ' N ' ' A' ' 68' ' ' HIS . 96.6 Cg_endo -86.63 -47.6 0.04 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.595 0 C-N-CA 122.479 2.12 . . . . 0.0 113.105 -179.697 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.595 ' HG2' ' HA ' ' A' ' 38' ' ' LYS . 0.0 OUTLIER -179.01 -164.12 0.07 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.662 -179.051 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 56.94 -82.07 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 111.7 0.259 . . . . 0.0 111.7 179.441 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.428 ' N ' ' O ' ' A' ' 70' ' ' LYS . 15.0 ptp180 -57.49 146.13 65.49 Favored Pre-proline 0 C--N 1.33 -0.241 0 CA-C-O 120.627 0.251 . . . . 0.0 111.182 -179.526 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -58.89 83.34 0.05 OUTLIER 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.613 2.209 . . . . 0.0 112.113 179.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.031 0 CA-C-O 118.363 -1.243 . . . . 0.0 112.381 -179.905 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 181' ' ' TYR . . . . . . . . . . . . . 88.3 t80 . . . . . 0 N--CA 1.486 1.359 0 CA-C-O 120.75 0.31 . . . . 0.0 111.134 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 182' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -74.0 70.68 1.53 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.956 179.959 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 183' ' ' GLY . . . . . . . . . . . . . . . -136.09 178.89 18.39 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.391 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 184' ' ' TRP . . . . . . . . . . . . . 4.6 m95 59.52 100.14 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.787 0.327 . . . . 0.0 110.859 -179.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 185' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -140.77 -46.43 0.4 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.847 -179.895 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 186' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -117.14 104.23 11.01 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.953 179.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 187' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -62.23 -150.3 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.536 179.821 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 188' ' ' VAL . . . . . 0.406 ' HB ' ' CE1' ' B' ' 190' ' ' TYR . 0.2 OUTLIER -79.43 172.35 1.14 Allowed 'Isoleucine or valine' 0 N--CA 1.456 -0.169 0 CA-C-O 120.823 0.344 . . . . 0.0 110.941 -179.85 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 189' ' ' TYR . . . . . . . . . . . . . 80.1 m-85 -85.75 136.98 33.12 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.249 -179.746 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 190' ' ' TYR . . . . . 0.444 ' CE2' ' HB2' ' A' ' 38' ' ' LYS . 24.3 m-85 -139.83 122.32 16.17 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.689 179.755 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 191' ' ' THR . . . . . . . . . . . . . 85.8 m -89.66 49.38 1.73 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.19 0.519 . . . . 0.0 111.177 179.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 192' ' ' CYS . . . . . 0.697 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.0 OUTLIER -90.07 172.56 8.75 Favored 'General case' 0 CA--C 1.498 -1.029 0 CA-C-O 121.752 0.787 . . . . 0.0 110.985 179.561 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 193' ' ' CYS . . . . . 0.697 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.1 OUTLIER 41.31 73.36 0.9 Allowed Pre-proline 0 C--N 1.314 -0.946 0 CA-C-N 113.625 -1.625 . . . . 0.0 112.172 173.706 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 194' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -65.06 -87.42 0.0 OUTLIER 'Trans proline' 0 CA--C 1.531 0.331 0 C-N-CA 122.555 2.17 . . . . 0.0 112.391 -179.749 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 30.9 t0 -106.14 13.64 28.74 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.566 0.222 . . . . 0.0 111.539 -179.805 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 196' ' ' THR . . . . . 0.754 ' C ' ' H ' ' B' ' 198' ' ' TYR . 77.3 p -79.89 -22.32 0.36 Allowed Pre-proline 0 C--N 1.331 -0.208 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 179.951 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 197' ' ' PRO . . . . . 0.664 ' CD ' ' N ' ' B' ' 196' ' ' THR . 17.2 Cg_exo -64.73 27.87 0.08 OUTLIER 'Trans proline' 0 C--N 1.355 0.878 0 C-N-CA 121.329 1.353 . . . . 0.0 109.622 177.172 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 198' ' ' TYR . . . . . 0.754 ' H ' ' C ' ' B' ' 196' ' ' THR . 13.0 t80 . . . . . 0 C--O 1.249 1.026 0 CA-C-N 114.283 -1.326 . . . . 0.0 111.28 -178.739 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 1.2 mm . . . . . 0 N--CA 1.487 1.419 0 CA-C-O 120.758 0.313 . . . . 0.0 110.781 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . 0.411 ' CG1' HG21 ' A' ' 15' ' ' THR . 1.0 OUTLIER -96.41 146.95 6.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.921 -179.818 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 29.2 p -127.0 116.45 20.78 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 112.37 0.507 . . . . 0.0 112.37 -178.68 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . 0.719 ' HA ' ' HA ' ' A' ' 14' ' ' VAL . 0.6 OUTLIER -46.35 166.3 0.02 OUTLIER 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.278 179.163 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.446 ' CG2' ' O ' ' A' ' 13' ' ' ALA . 21.2 p -88.91 126.09 35.23 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.924 -179.843 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -121.04 28.82 7.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.069 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -48.26 -30.36 4.71 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 121.018 0.437 . . . . 0.0 111.046 179.797 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 88.0 m -165.61 -68.96 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.239 179.702 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.454 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER -102.75 169.39 7.56 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.173 179.506 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.542 ' HG3' ' CA ' ' B' ' 195' ' ' ASP . 9.7 Cg_endo -51.64 -47.54 25.79 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.365 2.043 . . . . 0.0 111.893 179.672 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.436 ' O ' ' CB ' ' A' ' 12' ' ' SER . 31.1 mm 64.14 -103.05 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.982 179.838 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.436 ' CB ' ' O ' ' A' ' 11' ' ' ILE . 4.1 t 162.95 -35.12 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.779 0.323 . . . . 0.0 110.79 179.892 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.446 ' O ' ' CG2' ' A' ' 5' ' ' THR . . . -57.81 111.12 1.05 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.658 -179.511 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.719 ' HA ' ' HA ' ' A' ' 4' ' ' HIS . 0.1 OUTLIER -97.66 169.19 1.52 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.727 179.674 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.411 HG21 ' CG1' ' A' ' 2' ' ' VAL . 1.2 p 74.59 158.28 0.2 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.595 -179.967 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.432 ' O ' ' HD3' ' A' ' 18' ' ' PRO . 0.0 OUTLIER 176.54 -48.76 0.0 OUTLIER Pre-proline 0 C--N 1.327 -0.379 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.225 -179.868 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.424 ' HD3' ' HB3' ' A' ' 16' ' ' CYS . 69.3 Cg_endo -98.46 78.72 0.06 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.721 0 C-N-CA 123.111 2.541 . . . . 0.0 113.723 -178.448 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.433 ' O ' ' N ' ' A' ' 20' ' ' GLU . 49.3 Cg_endo -68.56 162.86 39.1 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.013 1.809 . . . . 0.0 111.106 178.808 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 53.26 -88.45 0.01 OUTLIER Glycine 0 CA--C 1.519 0.295 0 C-N-CA 120.528 -0.844 . . . . 0.0 112.518 -179.866 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.433 ' N ' ' O ' ' A' ' 18' ' ' PRO . 14.5 mt-10 -140.07 111.82 7.41 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.807 0.337 . . . . 0.0 110.884 179.842 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.493 ' O ' ' C ' ' A' ' 22' ' ' LEU . 0.7 OUTLIER -178.5 34.09 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.081 179.904 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.493 ' C ' ' O ' ' A' ' 21' ' ' ASN . 0.2 OUTLIER -12.85 124.94 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 -179.822 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.581 ' O ' ' N ' ' A' ' 44' ' ' CYS . 0.1 OUTLIER -43.65 -29.41 0.5 Allowed 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.898 -179.691 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.427 ' CD2' ' HB2' ' A' ' 45' ' ' ALA . 0.2 OUTLIER 60.58 126.4 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.997 0.427 . . . . 0.0 111.344 179.51 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 3.0 ttt180 -117.21 78.06 1.18 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.801 179.75 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 2.9 mtmm -64.67 154.55 36.2 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.13 -179.83 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 1.8 ttm -157.5 100.45 1.8 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.52 179.862 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -56.42 -36.74 69.3 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.476 -179.544 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER 59.63 -168.4 0.15 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.826 0.346 . . . . 0.0 110.72 179.914 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 26.7 p-10 -91.71 -38.3 12.49 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.816 179.847 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -171.93 -56.08 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.809 179.855 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -131.96 17.48 4.64 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.974 179.58 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 93.0 m 56.84 165.76 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.945 0.402 . . . . 0.0 111.337 179.755 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 11.4 p 172.13 -34.16 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.499 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -161.36 -43.74 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.584 179.937 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.53 -172.22 1.75 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.967 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.472 ' O ' ' N ' ' A' ' 39' ' ' VAL . . . 169.69 -38.62 0.2 Allowed Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 121.141 -0.552 . . . . 0.0 111.887 -179.844 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.645 ' HA ' ' HB2' ' A' ' 70' ' ' LYS . 0.0 OUTLIER 22.92 -83.12 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 113.534 0.938 . . . . 0.0 113.534 179.673 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.711 ' HA ' ' O ' ' B' ' 189' ' ' TYR . 11.2 t -38.7 118.62 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 N-CA-C 112.664 0.616 . . . . 0.0 112.664 -178.617 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 35.3 m -115.0 171.64 4.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.02 -179.83 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -173.96 33.96 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.339 179.901 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.83 139.49 55.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.313 179.476 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 160.54 40.32 0.02 OUTLIER Glycine 0 C--N 1.332 0.354 0 C-N-CA 119.911 -1.138 . . . . 0.0 113.241 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.581 ' N ' ' O ' ' A' ' 23' ' ' CYS . 13.7 m 60.61 152.56 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.075 0.464 . . . . 0.0 111.659 179.045 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.427 ' HB2' ' CD2' ' A' ' 24' ' ' TYR . . . -133.0 -77.97 0.49 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.997 179.96 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 170.75 -31.26 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.347 179.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 13.5 t -141.35 -165.55 1.99 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.345 -179.686 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.468 ' H ' ' HD2' ' A' ' 49' ' ' PRO . 34.5 t -148.03 -60.46 0.02 OUTLIER Pre-proline 0 C--N 1.331 -0.205 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.494 -179.993 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.468 ' HD2' ' H ' ' A' ' 48' ' ' CYS . 3.4 Cg_exo -39.66 -26.83 0.17 Allowed 'Trans proline' 0 C--N 1.353 0.77 0 C-N-CA 122.519 2.146 . . . . 0.0 111.52 179.083 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.429 ' N ' ' O ' ' A' ' 48' ' ' CYS . 0.9 OUTLIER -41.47 136.05 1.89 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.42 178.708 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 170.63 59.81 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.915 0.388 . . . . 0.0 111.043 179.62 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.469 ' HB2' ' HD3' ' A' ' 53' ' ' PRO . 0.0 OUTLIER -97.14 -67.07 0.07 OUTLIER Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.101 179.878 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . 0.469 ' HD3' ' HB2' ' A' ' 52' ' ' LYS . 72.2 Cg_endo -76.14 166.52 27.66 Favored 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 122.132 1.888 . . . . 0.0 112.286 179.907 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -73.76 84.0 1.64 Allowed 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.935 179.998 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -111.79 -138.41 0.38 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.048 -179.936 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.506 ' O ' ' O ' ' A' ' 57' ' ' VAL . 0.5 OUTLIER -139.3 -102.48 0.17 Allowed 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.853 -179.51 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.506 ' O ' ' O ' ' A' ' 56' ' ' GLU . 20.9 m 49.61 159.88 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.391 0 CA-C-O 121.376 0.607 . . . . 0.0 112.426 179.785 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -149.59 17.84 0.91 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.075 179.86 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 7.8 t 49.61 97.47 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.719 179.674 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.412 ' HB3' ' CB ' ' A' ' 23' ' ' CYS . 21.1 t -84.71 -108.71 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 179.162 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 2.8 p 69.62 -59.22 0.5 Allowed 'General case' 0 N--CA 1.463 0.191 0 N-CA-C 111.955 0.354 . . . . 0.0 111.955 179.187 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 23.8 p -51.56 -173.55 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.938 0.399 . . . . 0.0 111.6 -179.403 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . 0.438 ' O ' ' N ' ' A' ' 65' ' ' CYS . 2.0 p30 -39.88 160.1 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.754 -179.56 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 29.6 mtpt -40.73 92.49 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.484 -179.619 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . 0.438 ' N ' ' O ' ' A' ' 63' ' ' ASP . 4.1 m -38.75 -40.78 0.65 Allowed 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.247 -179.914 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.447 ' ND2' ' CE1' ' A' ' 4' ' ' HIS . 1.0 OUTLIER 43.23 55.29 11.21 Favored Pre-proline 0 N--CA 1.463 0.196 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.577 179.621 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -71.6 -8.32 22.97 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.424 2.083 . . . . 0.0 112.532 179.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 21.7 m170 60.19 158.83 0.11 Allowed Pre-proline 0 C--N 1.332 -0.189 0 CA-C-N 116.53 -0.304 . . . . 0.0 110.591 -179.835 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . 0.481 ' HA ' ' OG1' ' B' ' 191' ' ' THR . 67.1 Cg_exo -43.65 -66.43 0.16 Allowed 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.601 2.201 . . . . 0.0 113.106 -179.45 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.645 ' HB2' ' HA ' ' A' ' 38' ' ' LYS . 0.0 OUTLIER -134.73 178.91 6.64 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 120.645 0.26 . . . . 0.0 110.939 -179.408 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.53 ' O ' ' HD2' ' A' ' 72' ' ' ARG . 14.5 tp60 -115.44 -11.24 11.86 Favored 'General case' 0 N--CA 1.463 0.218 0 N-CA-C 111.915 0.339 . . . . 0.0 111.915 -179.597 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.53 ' HD2' ' O ' ' A' ' 71' ' ' GLN . 0.0 OUTLIER 48.43 168.14 0.03 OUTLIER Pre-proline 0 N--CA 1.466 0.344 0 CA-C-O 121.1 0.476 . . . . 0.0 112.075 179.855 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.418 ' CD ' ' HB2' ' A' ' 72' ' ' ARG . 17.1 Cg_exo -67.52 136.22 38.84 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.682 2.255 . . . . 0.0 112.168 -179.56 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.092 0 CA-C-O 118.402 -1.221 . . . . 0.0 112.37 179.978 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 181' ' ' TYR . . . . . 0.454 ' O ' ' HG2' ' B' ' 182' ' ' ARG . 4.8 t80 . . . . . 0 N--CA 1.486 1.364 0 CA-C-O 120.746 0.308 . . . . 0.0 111.19 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 182' ' ' ARG . . . . . 0.454 ' HG2' ' O ' ' B' ' 181' ' ' TYR . 0.1 OUTLIER 60.74 152.32 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.03 179.988 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 183' ' ' GLY . . . . . . . . . . . . . . . -121.56 108.71 1.37 Allowed Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.579 -179.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 184' ' ' TRP . . . . . . . . . . . . . 3.6 p-90 -125.98 -37.87 2.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.771 0.319 . . . . 0.0 110.947 179.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 185' ' ' LYS . . . . . . . . . . . . . 8.4 tttt -138.71 132.28 30.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.717 179.806 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 186' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -153.55 37.16 0.46 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.943 -179.825 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 187' ' ' TRP . . . . . . . . . . . . . 88.2 m95 -80.27 159.79 25.74 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.012 0.434 . . . . 0.0 110.874 179.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -93.32 160.44 2.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.218 -179.743 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 189' ' ' TYR . . . . . 0.711 ' O ' ' HA ' ' A' ' 39' ' ' VAL . 0.1 OUTLIER -147.18 -101.56 0.09 Allowed 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.242 179.444 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 190' ' ' TYR . . . . . 0.445 ' CD1' ' O ' ' B' ' 190' ' ' TYR . 0.1 OUTLIER -79.69 149.21 31.29 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-O 120.94 0.4 . . . . 0.0 111.575 -179.91 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 191' ' ' THR . . . . . 0.481 ' OG1' ' HA ' ' A' ' 69' ' ' PRO . 0.2 OUTLIER -57.6 -162.94 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.287 -179.767 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 192' ' ' CYS . . . . . 0.724 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.2 OUTLIER -90.69 -60.81 1.82 Allowed 'General case' 0 CA--C 1.502 -0.871 0 CA-C-O 121.652 0.739 . . . . 0.0 112.431 -179.193 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 193' ' ' CYS . . . . . 0.724 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.0 OUTLIER -157.45 170.98 8.06 Favored Pre-proline 0 N--CA 1.438 -1.027 0 CA-C-N 114.055 -1.43 . . . . 0.0 111.737 -173.209 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 194' ' ' PRO . . . . . 0.428 ' HD2' ' CB ' ' B' ' 193' ' ' CYS . 1.5 Cg_endo -44.36 -70.85 0.06 OUTLIER 'Trans proline' 0 C--N 1.35 0.658 0 C-N-CA 123.149 2.566 . . . . 0.0 112.807 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 195' ' ' ASP . . . . . 0.542 ' CA ' ' HG3' ' A' ' 10' ' ' PRO . 0.6 OUTLIER -144.37 -85.73 0.13 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.004 -179.682 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 196' ' ' THR . . . . . 0.613 ' C ' ' H ' ' B' ' 198' ' ' TYR . 0.2 OUTLIER -157.06 43.53 0.18 Allowed Pre-proline 0 C--N 1.332 -0.185 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.817 -179.722 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 197' ' ' PRO . . . . . 0.491 ' CD ' ' N ' ' B' ' 196' ' ' THR . 72.7 Cg_endo -74.13 17.18 0.52 Allowed 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 121.627 1.551 . . . . 0.0 109.016 176.203 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 198' ' ' TYR . . . . . 0.613 ' H ' ' C ' ' B' ' 196' ' ' THR . 29.6 t80 . . . . . 0 C--O 1.249 1.064 0 CA-C-N 113.875 -1.512 . . . . 0.0 111.357 -178.781 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . 0.423 ' O ' ' HB ' ' A' ' 2' ' ' VAL . 1.3 tp . . . . . 0 N--CA 1.487 1.407 0 CA-C-O 120.508 0.194 . . . . 0.0 111.079 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . 0.423 ' HB ' ' O ' ' A' ' 1' ' ' ILE . 9.9 p 177.08 147.0 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.517 -0.31 . . . . 0.0 110.847 179.902 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.41 ' N ' HG23 ' A' ' 2' ' ' VAL . 0.5 OUTLIER -154.9 131.1 10.31 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.77 0.319 . . . . 0.0 111.265 -179.847 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . 0.407 ' HA ' ' HA ' ' A' ' 14' ' ' VAL . 59.2 m-70 -48.69 171.75 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.944 179.712 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -75.58 -167.46 0.68 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.661 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.432 ' O ' ' CB ' ' A' ' 7' ' ' ALA . 9.6 t -46.07 -25.05 0.51 Allowed 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.364 179.819 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.432 ' CB ' ' O ' ' A' ' 6' ' ' THR . . . 83.36 78.89 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.534 179.71 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -87.4 -43.35 12.17 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.2 179.234 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.587 ' CB ' ' HD3' ' A' ' 10' ' ' PRO . 2.3 m -161.54 -78.54 0.01 OUTLIER Pre-proline 0 CA--C 1.535 0.375 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.905 179.308 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.587 ' HD3' ' CB ' ' A' ' 9' ' ' SER . 88.3 Cg_endo -80.11 -97.41 0.01 OUTLIER 'Trans proline' 0 C--N 1.353 0.808 0 C-N-CA 121.737 1.625 . . . . 0.0 112.312 179.646 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 2.8 pt -161.72 162.67 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.335 -0.052 0 CA-C-O 120.655 0.264 . . . . 0.0 110.582 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 176.35 148.54 0.11 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.013 0.435 . . . . 0.0 111.535 179.973 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 43.9 42.51 4.62 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.803 -0.635 . . . . 0.0 112.01 179.373 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.411 ' O ' ' CG2' ' A' ' 2' ' ' VAL . 2.0 t -65.18 101.81 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.491 179.638 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER 165.11 122.33 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.137 -179.393 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -114.75 83.11 8.77 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.009 -179.714 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.442 ' N ' ' CD ' ' A' ' 18' ' ' PRO . 28.4 Cg_exo -59.16 -47.94 15.75 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.332 2.021 . . . . 0.0 112.562 -179.988 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.442 ' CD ' ' N ' ' A' ' 17' ' ' PRO . 41.5 Cg_exo -56.74 175.1 0.32 Allowed 'Trans proline' 0 C--N 1.347 0.492 0 C-N-CA 122.394 2.063 . . . . 0.0 112.351 179.935 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 55.47 -166.69 3.2 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.872 -0.68 . . . . 0.0 112.819 179.756 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -159.8 22.93 0.18 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.636 0.255 . . . . 0.0 111.064 179.869 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.482 ' N ' ' O ' ' A' ' 45' ' ' ALA . 4.8 m120 -137.02 10.0 3.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.318 179.612 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.502 ' O ' ' HA ' ' A' ' 44' ' ' CYS . 0.0 OUTLIER 70.11 -172.18 0.17 Allowed 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 112.846 0.684 . . . . 0.0 112.846 178.841 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.522 ' HA ' ' HA ' ' A' ' 44' ' ' CYS . 56.3 m -59.88 175.61 0.37 Allowed 'General case' 0 N--CA 1.46 0.048 0 CA-C-N 114.863 -1.062 . . . . 0.0 112.002 -179.738 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.469 ' CE1' ' HB2' ' A' ' 48' ' ' CYS . 4.3 m-30 -119.17 -54.52 2.2 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.42 179.476 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.437 ' CG ' ' O ' ' A' ' 24' ' ' TYR . 0.0 OUTLIER 78.18 170.98 0.2 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.967 -179.041 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.441 ' CG ' ' CG2' ' A' ' 57' ' ' VAL . 0.0 OUTLIER 177.95 74.93 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.447 -179.523 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 22.7 mtp -81.86 -176.37 6.07 Favored 'General case' 0 C--N 1.321 -0.644 0 C-N-CA 120.459 -0.496 . . . . 0.0 111.169 -179.416 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' TRP . . . . . 0.459 ' HA ' ' CE3' ' A' ' 28' ' ' TRP . 0.0 OUTLIER -133.38 86.93 2.34 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.503 179.885 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . 0.434 ' HA ' ' HG2' ' A' ' 36' ' ' ARG . 0.1 OUTLIER -148.34 66.29 1.08 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.587 -179.74 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.432 ' HB2' ' CZ3' ' A' ' 28' ' ' TRP . 1.2 t0 -52.08 90.51 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.845 -179.275 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . 38.9 -90.54 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.008 -0.542 . . . . 0.0 112.208 179.434 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.426 ' N ' ' O ' ' A' ' 30' ' ' ASP . 0.2 OUTLIER -64.07 79.7 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.983 0.42 . . . . 0.0 110.758 179.998 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 66.1 m -71.04 -73.44 0.17 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.909 -179.864 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.8 m 69.04 -64.8 0.31 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.918 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 45.7 m -137.55 53.89 1.84 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.974 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.434 ' HG2' ' HA ' ' A' ' 29' ' ' CYS . 2.1 tpt180 -100.29 -149.8 0.37 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.76 179.864 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -159.92 144.4 10.06 Favored Glycine 0 C--N 1.334 0.418 0 C-N-CA 120.294 -0.955 . . . . 0.0 112.844 -179.68 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.537 ' HB2' ' CB ' ' A' ' 70' ' ' LYS . 0.2 OUTLIER -73.2 102.65 3.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.135 0.493 . . . . 0.0 111.36 -179.759 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.55 ' HA ' ' HA ' ' B' ' 190' ' ' TYR . 55.1 t -88.13 143.4 11.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.999 -179.928 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 11.7 m -120.51 164.5 16.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.079 -179.639 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -175.79 -40.64 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.131 -179.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 62.41 171.1 0.13 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.936 -179.845 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.409 ' HA3' ' HB2' ' A' ' 24' ' ' TYR . . . -159.52 -64.41 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.728 -0.748 . . . . 0.0 112.468 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.522 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 10.8 t 66.24 117.0 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.609 0.242 . . . . 0.0 110.814 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.482 ' O ' ' N ' ' A' ' 21' ' ' ASN . . . -164.51 -170.32 2.0 Favored 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 120.618 -0.433 . . . . 0.0 111.83 -179.976 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.409 ' HA ' ' HB2' ' A' ' 21' ' ' ASN . . . -132.17 34.55 3.78 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.215 -179.851 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.5 m -171.93 94.92 0.15 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.576 -179.691 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.48 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 1.8 t -147.24 46.06 0.47 Allowed Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.987 179.909 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.48 ' CD ' ' N ' ' A' ' 48' ' ' CYS . 87.0 Cg_endo -79.11 -5.38 14.43 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.396 2.064 . . . . 0.0 111.447 178.613 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 6.3 t -65.74 163.73 15.99 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.318 -179.703 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.559 ' O ' ' CB ' ' A' ' 52' ' ' LYS . 0.5 OUTLIER 172.36 175.35 0.09 Allowed 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.828 179.669 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.559 ' CB ' ' O ' ' A' ' 51' ' ' LYS . 4.8 mtpm? 115.79 -48.32 0.0 OUTLIER Pre-proline 0 N--CA 1.475 0.824 0 C-N-CA 124.171 0.989 . . . . 0.0 111.425 179.84 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . 0.482 ' HD3' ' HB2' ' A' ' 52' ' ' LYS . 24.9 Cg_exo -62.28 139.61 78.46 Favored 'Trans proline' 0 C--N 1.349 0.575 0 C-N-CA 122.131 1.887 . . . . 0.0 111.994 179.893 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -67.44 72.58 0.13 Allowed 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.865 -179.894 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -112.42 -174.46 2.46 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.89 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -119.82 -21.22 7.29 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.512 -179.81 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.441 ' CG2' ' CG ' ' A' ' 26' ' ' LYS . 60.9 t -48.01 -65.69 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.153 0 CA-C-O 121.385 0.612 . . . . 0.0 110.417 179.652 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 4.1 p 59.65 8.71 1.35 Allowed 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.257 -0.883 . . . . 0.0 111.614 179.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 3.9 m 58.33 150.41 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.143 0 CA-C-O 121.011 0.434 . . . . 0.0 110.937 179.62 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.423 ' O ' ' O ' ' A' ' 21' ' ' ASN . 0.1 OUTLIER -122.26 138.18 54.59 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.08 -179.217 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.45 ' HA ' ' CB ' ' A' ' 22' ' ' LEU . 54.2 p -176.8 89.26 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.023 0.439 . . . . 0.0 111.062 179.572 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER 164.24 73.23 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.027 179.939 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . 0.41 ' O ' ' N ' ' A' ' 65' ' ' CYS . 0.6 OUTLIER 63.64 178.39 0.16 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.283 -179.38 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.487 ' CG ' ' O ' ' A' ' 64' ' ' LYS . 0.0 OUTLIER -52.75 90.57 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.406 0.622 . . . . 0.0 110.921 -179.912 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . 0.41 ' N ' ' O ' ' A' ' 63' ' ' ASP . 8.0 p -101.13 -11.48 19.55 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.63 -179.463 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 49.6 t30 -52.96 126.59 43.25 Favored Pre-proline 0 C--N 1.328 -0.36 0 C-N-CA 121.019 -0.272 . . . . 0.0 111.101 -179.229 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -74.04 119.39 5.82 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.526 2.151 . . . . 0.0 112.639 -179.872 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.484 ' HB3' ' HD2' ' A' ' 69' ' ' PRO . 1.7 m80 -69.83 178.51 1.0 Allowed Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.156 -0.474 . . . . 0.0 109.724 179.355 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . 0.484 ' HD2' ' HB3' ' A' ' 68' ' ' HIS . 69.8 Cg_exo -43.17 148.16 0.65 Allowed 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.438 2.092 . . . . 0.0 112.515 -179.979 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.537 ' CB ' ' HB2' ' A' ' 38' ' ' LYS . 0.0 OUTLIER -46.16 135.45 7.71 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.035 0.445 . . . . 0.0 111.257 -179.305 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -126.06 -75.04 0.59 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.551 -178.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -42.28 151.49 0.35 Allowed Pre-proline 0 N--CA 1.465 0.314 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.566 -179.424 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_exo -48.85 163.27 0.31 Allowed 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.663 2.242 . . . . 0.0 112.694 -179.794 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.327 -1.263 . . . . 0.0 112.351 179.99 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 181' ' ' TYR . . . . . . . . . . . . . 1.4 t80 . . . . . 0 N--CA 1.486 1.334 0 CA-C-O 120.912 0.387 . . . . 0.0 111.201 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 182' ' ' ARG . . . . . . . . . . . . . 24.7 mmt85 59.72 72.61 0.52 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.926 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 183' ' ' GLY . . . . . . . . . . . . . . . -137.33 -149.01 5.51 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.525 -179.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 184' ' ' TRP . . . . . . . . . . . . . 3.4 p90 -161.88 128.98 3.88 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.77 0.319 . . . . 0.0 110.796 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 185' ' ' LYS . . . . . . . . . . . . . 2.0 tppt? -111.54 -75.44 0.61 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.914 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 186' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -97.48 62.66 1.72 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.122 -179.879 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 187' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -59.94 -160.41 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.663 179.793 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 188' ' ' VAL . . . . . 0.461 HG21 ' CD1' ' B' ' 190' ' ' TYR . 3.5 p -79.85 130.67 35.68 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.547 0 CA-C-O 120.779 0.323 . . . . 0.0 110.583 179.942 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 189' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -95.39 31.45 1.97 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.617 -179.304 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 190' ' ' TYR . . . . . 0.55 ' HA ' ' HA ' ' A' ' 39' ' ' VAL . 0.1 OUTLIER -86.79 153.8 21.4 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.664 -0.244 . . . . 0.0 110.818 179.865 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 191' ' ' THR . . . . . 0.434 ' CB ' ' HA ' ' A' ' 69' ' ' PRO . 43.2 p -42.53 161.38 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 116.616 -0.266 . . . . 0.0 111.039 179.704 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 192' ' ' CYS . . . . . 0.704 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.0 OUTLIER -90.24 -64.72 1.1 Allowed 'General case' 0 CA--C 1.501 -0.932 0 N-CA-C 112.774 0.657 . . . . 0.0 112.774 -179.047 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 193' ' ' CYS . . . . . 0.704 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.0 OUTLIER -162.63 155.61 16.8 Favored Pre-proline 0 N--CA 1.439 -1.006 0 CA-C-N 114.736 -1.12 . . . . 0.0 112.15 -172.986 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 194' ' ' PRO . . . . . 0.416 ' HA ' ' HG2' ' A' ' 69' ' ' PRO . 56.8 Cg_endo -98.02 137.58 0.4 Allowed 'Trans proline' 0 N--CA 1.455 -0.778 0 C-N-CA 123.384 2.723 . . . . 0.0 112.981 -179.646 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 67.97 129.77 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 121.114 0.483 . . . . 0.0 111.767 179.044 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 196' ' ' THR . . . . . 0.573 ' C ' ' H ' ' B' ' 198' ' ' TYR . 52.0 m -160.11 44.48 0.17 Allowed Pre-proline 0 C--N 1.331 -0.235 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.304 179.645 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 197' ' ' PRO . . . . . 0.508 ' CD ' ' N ' ' B' ' 196' ' ' THR . 80.9 Cg_endo -74.93 14.31 0.87 Allowed 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 121.745 1.63 . . . . 0.0 108.919 176.234 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 198' ' ' TYR . . . . . 0.573 ' H ' ' C ' ' B' ' 196' ' ' THR . 59.3 t80 . . . . . 0 C--O 1.248 1.022 0 CA-C-N 113.896 -1.502 . . . . 0.0 111.299 -178.84 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . 0.583 ' CG2' ' C ' ' A' ' 62' ' ' THR . 9.7 mm . . . . . 0 N--CA 1.487 1.406 0 CA-C-O 120.817 0.342 . . . . 0.0 111.156 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . 0.504 ' CG1' ' HA ' ' A' ' 15' ' ' THR . 0.0 OUTLIER 45.01 -171.64 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 CA-C-N 116.155 -0.475 . . . . 0.0 112.231 179.461 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.442 ' O ' ' O ' ' A' ' 4' ' ' HIS . 1.0 OUTLIER -148.09 125.73 11.79 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 116.554 -0.294 . . . . 0.0 110.81 -178.827 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . 0.537 ' HA ' ' HA ' ' A' ' 14' ' ' VAL . 4.2 m-70 -37.83 162.95 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 112.073 0.397 . . . . 0.0 112.073 -179.809 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.471 HG22 ' HB2' ' A' ' 12' ' ' SER . 0.2 OUTLIER -137.85 163.36 31.62 Favored 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 112.452 0.538 . . . . 0.0 112.452 -178.354 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.445 ' OG1' ' OG ' ' A' ' 12' ' ' SER . 8.4 p 67.23 -43.34 0.45 Allowed 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 115.378 -0.828 . . . . 0.0 111.674 -179.749 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.448 ' HB1' ' CG ' ' A' ' 67' ' ' PRO . . . 77.07 -179.76 0.14 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.725 0.298 . . . . 0.0 110.782 -179.678 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 9.3 m 55.73 21.01 4.34 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.466 -0.333 . . . . 0.0 110.552 -179.453 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 7.0 t 167.52 143.92 0.06 OUTLIER Pre-proline 0 CA--C 1.53 0.196 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.604 -179.818 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.429 ' HA ' ' CE1' ' A' ' 4' ' ' HIS . 60.9 Cg_endo -82.51 -20.16 5.95 Favored 'Trans proline' 0 C--N 1.344 0.308 0 C-N-CA 123.049 2.499 . . . . 0.0 112.04 179.719 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 14.4 tt -37.8 -26.92 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 N-CA-C 113.699 1.0 . . . . 0.0 113.699 -179.255 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.471 ' HB2' HG22 ' A' ' 5' ' ' THR . 0.8 OUTLIER -80.61 5.46 15.42 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.68 0.276 . . . . 0.0 111.7 -179.275 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.5 ' O ' ' HA ' ' A' ' 4' ' ' HIS . . . 56.81 -116.78 1.0 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.585 -179.967 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.537 ' HA ' ' HA ' ' A' ' 4' ' ' HIS . 4.4 m -159.82 125.02 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.428 0 CA-C-O 120.754 0.312 . . . . 0.0 110.93 -179.503 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.504 ' HA ' ' CG1' ' A' ' 2' ' ' VAL . 0.5 OUTLIER 176.78 142.95 0.08 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.96 179.952 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 5.0 t -158.98 74.29 3.46 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.958 -179.926 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.474 ' N ' ' CD ' ' A' ' 18' ' ' PRO . 31.2 Cg_exo -58.37 -45.52 30.2 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 122.612 2.208 . . . . 0.0 112.743 -179.838 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.474 ' CD ' ' N ' ' A' ' 17' ' ' PRO . 81.0 Cg_exo -47.56 -63.75 0.3 Allowed 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 122.535 2.157 . . . . 0.0 112.527 -179.891 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -99.43 146.84 18.14 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.186 179.805 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -138.41 29.43 2.43 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.614 0.245 . . . . 0.0 111.199 -179.742 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -141.02 85.39 1.98 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.222 -179.934 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.535 ' HA ' ' CA ' ' A' ' 61' ' ' SER . 1.4 mt 62.62 123.5 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.574 -0.284 . . . . 0.0 111.537 178.952 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.561 ' HA ' ' HA ' ' A' ' 44' ' ' CYS . 3.8 m -71.8 157.84 37.17 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-O 120.973 0.416 . . . . 0.0 110.788 179.861 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.588 ' CD2' ' O ' ' A' ' 44' ' ' CYS . 0.8 OUTLIER -65.31 65.3 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.778 -0.646 . . . . 0.0 112.012 -178.97 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.401 ' N ' ' O ' ' A' ' 23' ' ' CYS . 1.1 ttt85 -57.58 82.16 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.906 0.384 . . . . 0.0 110.45 179.215 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.493 ' HA ' ' O ' ' A' ' 56' ' ' GLU . 32.8 tttt -85.18 156.59 20.94 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.383 -179.231 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -177.34 100.84 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.764 179.708 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 34.4 t-105 -56.86 -75.27 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.776 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 1.1 m 49.83 81.09 0.06 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.4 179.257 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -62.5 99.38 0.14 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.713 179.737 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . 63.76 -79.55 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.974 -179.75 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -97.32 138.56 34.59 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.601 179.664 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 22.7 m -84.93 -79.08 0.23 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.069 -179.788 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 38.7 t 64.99 -74.76 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.936 -179.904 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.413 ' HA ' ' HE2' ' A' ' 70' ' ' LYS . 1.0 OUTLIER 179.65 29.68 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.09 179.809 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -119.28 -3.16 10.55 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.528 -179.803 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -124.17 54.76 0.72 Allowed Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.57 -0.824 . . . . 0.0 113.307 -179.23 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.434 ' O ' ' HA ' ' B' ' 190' ' ' TYR . 0.1 OUTLIER -92.05 26.16 2.58 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.719 0.26 . . . . 0.0 111.192 179.625 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.415 ' O ' ' CG2' ' A' ' 40' ' ' VAL . 47.8 t -48.93 -61.07 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 CA-C-O 120.881 0.372 . . . . 0.0 110.933 179.788 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.415 ' CG2' ' O ' ' A' ' 39' ' ' VAL . 18.7 m 45.48 -174.92 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.759 -0.655 . . . . 0.0 112.164 179.483 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -177.08 -70.85 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.596 -179.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.552 ' HA ' ' O ' ' A' ' 24' ' ' TYR . 0.6 OUTLIER 66.18 137.48 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.335 179.378 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.46 ' O ' ' HB2' ' A' ' 44' ' ' CYS . . . 161.91 50.1 0.02 OUTLIER Glycine 0 CA--C 1.521 0.459 0 C-N-CA 120.41 -0.9 . . . . 0.0 113.542 -179.993 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.588 ' O ' ' CD2' ' A' ' 24' ' ' TYR . 1.7 m 70.77 118.28 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 112.635 0.606 . . . . 0.0 112.635 179.034 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.496 ' HA ' ' CE1' ' A' ' 24' ' ' TYR . . . -122.48 174.29 7.14 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.537 179.614 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.547 ' O ' ' CG2' ' A' ' 47' ' ' THR . . . -101.76 78.71 1.85 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.479 179.77 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.547 ' CG2' ' O ' ' A' ' 46' ' ' ALA . 3.5 t 61.79 173.26 0.12 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.637 -0.71 . . . . 0.0 111.507 -179.727 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.676 ' O ' ' N ' ' A' ' 50' ' ' SER . 6.0 m -69.74 -50.77 17.06 Favored Pre-proline 0 C--N 1.331 -0.224 0 CA-C-N 116.089 -0.505 . . . . 0.0 112.287 -179.031 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.458 ' HD2' ' N ' ' A' ' 48' ' ' CYS . 42.3 Cg_exo -34.1 80.82 0.0 OUTLIER 'Trans proline' 0 C--N 1.353 0.787 0 C-N-CA 122.663 2.242 . . . . 0.0 111.622 179.838 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.676 ' N ' ' O ' ' A' ' 48' ' ' CYS . 3.6 t -161.26 -34.77 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.12 -0.945 . . . . 0.0 111.208 -177.571 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -43.08 -55.85 3.66 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.83 -179.492 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.454 ' CB ' ' CD ' ' A' ' 53' ' ' PRO . 0.0 OUTLIER -45.99 -65.68 0.63 Allowed Pre-proline 0 C--N 1.331 -0.21 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.074 -179.75 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . 0.454 ' CD ' ' CB ' ' A' ' 52' ' ' LYS . 32.7 Cg_endo -64.58 -154.12 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.088 1.858 . . . . 0.0 110.965 178.916 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -45.0 93.7 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.694 0 CA-C-O 120.954 0.406 . . . . 0.0 110.843 179.671 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.497 ' O ' ' CG ' ' A' ' 56' ' ' GLU . 0.0 OUTLIER -61.33 -155.55 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.453 -179.062 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.497 ' CG ' ' O ' ' A' ' 55' ' ' GLU . 2.5 pt-20 58.34 41.28 23.4 Favored 'General case' 0 CA--C 1.527 0.091 0 CA-C-O 121.369 0.604 . . . . 0.0 110.546 -178.898 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 47.6 t -159.61 -50.49 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.092 -0.958 . . . . 0.0 109.674 179.418 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 53.0 p 32.88 -91.41 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 115.002 -0.999 . . . . 0.0 112.711 179.38 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . 0.417 ' HB2' ' HB3' ' A' ' 22' ' ' LEU . 0.8 OUTLIER -179.78 155.94 0.66 Allowed 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.4 -179.373 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.514 ' CB ' ' HB2' ' A' ' 23' ' ' CYS . 0.0 OUTLIER -130.71 4.3 4.57 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 112.06 0.392 . . . . 0.0 112.06 -179.434 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.535 ' CA ' ' HA ' ' A' ' 22' ' ' LEU . 82.4 p 44.63 -162.26 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.241 0 N-CA-C 110.22 -0.289 . . . . 0.0 110.22 -179.17 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' THR . . . . . 0.583 ' C ' ' CG2' ' A' ' 1' ' ' ILE . 71.4 p -99.03 123.05 43.06 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 179.291 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 5.1 p30 167.67 179.19 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.908 0.385 . . . . 0.0 111.046 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.4 ' O ' ' ND2' ' A' ' 66' ' ' ASN . 0.0 OUTLIER -80.67 58.67 3.35 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.395 179.52 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . 0.459 ' O ' ' O ' ' A' ' 66' ' ' ASN . 0.6 OUTLIER -59.49 -70.88 0.14 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.613 179.983 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.515 ' HB3' ' CG ' ' A' ' 4' ' ' HIS . 14.2 p30 49.69 161.64 0.04 OUTLIER Pre-proline 0 N--CA 1.463 0.22 0 CA-C-N 115.576 -0.738 . . . . 0.0 112.413 179.761 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . 0.448 ' CG ' ' HB1' ' A' ' 7' ' ' ALA . 16.9 Cg_exo -68.64 62.16 1.2 Allowed 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 123.193 2.596 . . . . 0.0 112.6 -179.6 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 56.7 p-80 -59.22 109.39 1.87 Allowed Pre-proline 0 C--N 1.328 -0.369 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.702 179.76 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -53.3 124.72 16.36 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.305 2.003 . . . . 0.0 111.989 -179.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.417 ' HG3' ' HG2' ' A' ' 38' ' ' LYS . 0.0 OUTLIER -90.79 -2.99 57.75 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.728 -179.487 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 31.7 tt0 -61.32 -17.98 56.36 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.612 -0.267 . . . . 0.0 111.379 -179.887 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.45 ' H ' ' HG3' ' A' ' 72' ' ' ARG . 0.0 OUTLIER -100.14 102.65 18.75 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-O 120.621 0.248 . . . . 0.0 111.079 -179.86 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_endo -79.93 172.86 13.48 Favored 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.615 2.21 . . . . 0.0 112.295 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.084 0 CA-C-O 118.323 -1.265 . . . . 0.0 112.586 -179.938 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 181' ' ' TYR . . . . . . . . . . . . . 15.8 t80 . . . . . 0 N--CA 1.485 1.304 0 CA-C-O 120.879 0.371 . . . . 0.0 111.058 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 182' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -144.88 -168.81 3.02 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.896 179.844 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 183' ' ' GLY . . . . . . . . . . . . . . . -155.67 -44.4 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.511 -179.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 184' ' ' TRP . . . . . 0.45 ' O ' ' CB ' ' B' ' 185' ' ' LYS . 48.2 p-90 -74.84 -178.76 3.85 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.651 0.262 . . . . 0.0 110.931 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 185' ' ' LYS . . . . . 0.45 ' CB ' ' O ' ' B' ' 184' ' ' TRP . 0.2 OUTLIER 86.99 -40.84 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.247 179.919 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 186' ' ' HIS . . . . . . . . . . . . . 12.8 t60 -80.23 -30.4 38.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.788 0.328 . . . . 0.0 110.986 -179.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 187' ' ' TRP . . . . . . . . . . . . . 48.8 m0 -58.54 178.69 0.1 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.105 -179.861 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -79.76 158.33 4.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.055 -179.757 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 189' ' ' TYR . . . . . 0.406 ' O ' ' HA ' ' A' ' 39' ' ' VAL . 0.6 OUTLIER -156.24 -26.44 0.1 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.682 -179.798 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 190' ' ' TYR . . . . . 0.438 ' CD1' ' N ' ' B' ' 190' ' ' TYR . 0.1 OUTLIER -160.12 125.84 4.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.731 0.301 . . . . 0.0 111.274 -179.538 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 191' ' ' THR . . . . . . . . . . . . . 2.0 m -90.02 76.73 6.97 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.319 179.39 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 192' ' ' CYS . . . . . 0.717 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.0 OUTLIER -90.57 174.13 7.69 Favored 'General case' 0 CA--C 1.499 -0.999 0 CA-C-O 122.162 0.982 . . . . 0.0 111.87 -179.152 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 193' ' ' CYS . . . . . 0.717 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.1 OUTLIER 43.93 81.41 0.25 Allowed Pre-proline 0 N--CA 1.441 -0.896 0 CA-C-N 113.114 -1.857 . . . . 0.0 112.6 173.507 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 194' ' ' PRO . . . . . 0.411 ' HB2' ' HD3' ' A' ' 10' ' ' PRO . 96.2 Cg_endo -83.36 -43.27 0.08 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.552 0 C-N-CA 122.69 2.26 . . . . 0.0 112.213 179.591 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -43.48 98.88 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.498 -179.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 196' ' ' THR . . . . . 0.68 ' N ' ' HD3' ' B' ' 197' ' ' PRO . 2.9 p -149.83 45.42 0.36 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.821 179.868 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 197' ' ' PRO . . . . . 0.68 ' HD3' ' N ' ' B' ' 196' ' ' THR . 2.5 Cg_endo -77.17 11.61 2.02 Favored 'Trans proline' 0 N--CA 1.455 -0.773 0 C-N-CA 121.851 1.701 . . . . 0.0 108.537 175.981 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 198' ' ' TYR . . . . . 0.534 ' H ' ' C ' ' B' ' 196' ' ' THR . 10.9 t80 . . . . . 0 C--O 1.249 1.063 0 CA-C-N 113.746 -1.57 . . . . 0.0 111.27 -178.796 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 19.2 mm . . . . . 0 N--CA 1.485 1.278 0 CA-C-O 120.846 0.355 . . . . 0.0 111.132 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 27.7 m -136.19 169.78 19.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.99 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 3.2 t -160.31 100.65 1.36 Allowed 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 -179.536 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 4.5 m-70 -36.01 120.36 0.62 Allowed 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.48 179.392 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -84.44 99.86 10.95 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.978 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.445 ' CG2' ' N ' ' A' ' 7' ' ' ALA . 0.4 OUTLIER 81.17 -53.97 0.3 Allowed 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.213 179.784 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.445 ' N ' ' CG2' ' A' ' 6' ' ' THR . . . 58.98 -96.14 0.06 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.681 -0.236 . . . . 0.0 110.884 -179.688 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 5.3 p . . . . . 0 CA--C 1.529 0.156 0 CA-C-O 120.673 0.273 . . . . 0.0 111.396 179.666 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.467 ' N ' ' HD2' ' A' ' 18' ' ' PRO . 46.2 Cg_exo . . . . . 0 CA--C 1.528 0.213 0 N-CA-C 112.691 0.227 . . . . 0.0 112.691 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.467 ' HD2' ' N ' ' A' ' 17' ' ' PRO . 71.8 Cg_endo -78.45 164.77 25.99 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.281 1.987 . . . . 0.0 112.36 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 48.37 87.12 0.01 OUTLIER Glycine 0 C--N 1.33 0.237 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.437 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -87.37 82.14 7.65 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.828 0.347 . . . . 0.0 111.263 -179.63 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -168.38 -74.49 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.968 179.73 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.958 HD23 ' CB ' ' A' ' 61' ' ' SER . 1.0 OUTLIER -125.45 154.42 42.03 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.018 -179.626 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.602 ' C ' ' H ' ' A' ' 44' ' ' CYS . 2.4 p -109.34 29.15 7.82 Favored 'General case' 0 CA--C 1.534 0.354 0 N-CA-C 112.228 0.455 . . . . 0.0 112.228 -179.172 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.64 ' O ' ' HB2' ' A' ' 60' ' ' CYS . 1.9 m-85 34.82 -159.25 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 122.774 0.43 . . . . 0.0 111.654 179.385 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.572 ' CB ' ' O ' ' A' ' 24' ' ' TYR . 1.2 mtp180 97.23 117.17 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 122.591 0.356 . . . . 0.0 111.513 179.749 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -147.98 -93.82 0.08 Allowed 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.236 178.725 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 1.9 mtm 172.15 -164.12 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.255 0 C-N-CA 121.108 -0.237 . . . . 0.0 110.773 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 18.1 t-105 -133.18 -84.53 0.46 Allowed 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 116.592 -0.276 . . . . 0.0 111.062 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER 54.53 175.14 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 120.813 0.339 . . . . 0.0 110.726 -179.63 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -86.21 -76.23 0.35 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.983 0.421 . . . . 0.0 110.277 179.456 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -118.1 -130.67 0.3 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.854 179.251 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.468 ' O ' ' N ' ' A' ' 34' ' ' SER . 26.7 p90 -68.47 -35.89 78.19 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 179.121 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER 34.62 -86.19 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 115.345 -0.843 . . . . 0.0 112.771 179.485 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.468 ' N ' ' O ' ' A' ' 32' ' ' PHE . 0.3 OUTLIER 78.32 28.54 0.48 Allowed 'General case' 0 N--CA 1.462 0.173 0 CA-C-O 120.967 0.413 . . . . 0.0 110.338 -179.175 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 1.6 p -152.95 -66.41 0.16 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.621 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -86.45 -155.36 0.25 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.718 179.821 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 88.91 20.19 47.88 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.711 -0.756 . . . . 0.0 112.49 -179.574 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.454 ' HA ' ' HG3' ' A' ' 70' ' ' LYS . 0.1 OUTLIER . . . . . 0 N--CA 1.464 0.233 0 CA-C-O 121.227 0.537 . . . . 0.0 111.629 -179.726 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' GLY . . . . . 0.459 ' N ' ' HG2' ' A' ' 25' ' ' ARG . . . . . . . . 0 N--CA 1.451 -0.318 0 CA-C-O 120.817 0.12 . . . . 0.0 113.336 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.602 ' H ' ' C ' ' A' ' 23' ' ' CYS . 0.1 OUTLIER 62.79 144.66 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.17 0.509 . . . . 0.0 112.286 178.819 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.577 ' HB3' ' CE1' ' A' ' 24' ' ' TYR . . . -147.06 -68.78 0.25 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.747 179.33 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.573 ' HB2' ' O ' ' A' ' 45' ' ' ALA . . . 166.14 -37.01 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.666 179.863 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.63 ' HA ' HD12 ' A' ' 22' ' ' LEU . 10.4 t -178.78 173.21 1.27 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.637 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.531 ' N ' ' HD3' ' A' ' 49' ' ' PRO . 22.3 p -142.76 52.81 2.42 Favored Pre-proline 0 C--N 1.331 -0.196 0 N-CA-C 111.995 0.369 . . . . 0.0 111.995 -179.778 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.6 ' HD3' HG23 ' A' ' 47' ' ' THR . 32.3 Cg_exo -57.52 -21.64 47.11 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 121.849 1.699 . . . . 0.0 110.82 178.526 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 3.5 t -61.46 -166.91 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.248 -0.887 . . . . 0.0 111.108 179.689 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 2.0 ptmm? 177.86 39.91 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.706 179.779 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.45 ' HD2' ' O ' ' A' ' 52' ' ' LYS . 0.0 OUTLIER -76.92 154.99 83.05 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.141 -179.924 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -71.19 -89.58 0.0 OUTLIER 'Trans proline' 0 CA--C 1.531 0.365 0 C-N-CA 122.457 2.105 . . . . 0.0 112.184 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.469 0.509 0 CA-C-O 120.597 0.237 . . . . 0.0 110.603 179.779 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.443 ' O ' ' HB3' ' A' ' 48' ' ' CYS . 0.2 OUTLIER . . . . . 0 N--CA 1.456 -0.159 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' CYS . . . . . 0.825 ' CB ' HD13 ' A' ' 22' ' ' LEU . 1.3 p 178.73 146.88 0.17 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.552 179.425 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.64 ' HB2' ' O ' ' A' ' 24' ' ' TYR . 11.9 m -133.96 84.68 2.14 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.462 -179.256 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.958 ' CB ' HD23 ' A' ' 22' ' ' LEU . 2.1 t -93.58 74.75 4.4 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.91 0.386 . . . . 0.0 110.832 179.879 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.417 HG22 ' H ' ' A' ' 63' ' ' ASP . 0.2 OUTLIER -157.95 -164.28 1.49 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.7 -179.999 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ASP . . . . . 0.417 ' H ' HG22 ' A' ' 62' ' ' THR . 10.8 p-10 -124.61 28.25 6.63 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.197 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER 179.54 43.81 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.05 0.452 . . . . 0.0 110.776 179.776 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 13.5 t -77.79 -27.23 50.15 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.084 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -58.52 105.32 0.52 Allowed Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.456 -179.65 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 7.1 Cg_exo -73.51 -156.16 0.05 OUTLIER 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.757 2.305 . . . . 0.0 111.908 179.576 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.423 ' CB ' ' HD2' ' A' ' 69' ' ' PRO . 0.7 OUTLIER -106.77 166.59 10.85 Favored Pre-proline 0 C--N 1.331 -0.211 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.818 179.831 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 69' ' ' PRO . . . . . 0.423 ' HD2' ' CB ' ' A' ' 68' ' ' HIS . 9.9 Cg_endo -53.47 177.33 0.07 OUTLIER 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.619 2.212 . . . . 0.0 112.528 -179.845 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.454 ' HG3' ' HA ' ' A' ' 38' ' ' LYS . 3.0 mmpt? -85.11 -56.48 3.53 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.351 -179.623 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 31.7 mt-30 . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.446 -179.682 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 192' ' ' CYS . . . . . 0.702 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.0 OUTLIER . . . . . 0 CA--C 1.499 -0.988 0 CA-C-O 122.06 0.933 . . . . 0.0 112.101 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 193' ' ' CYS . . . . . 0.702 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.1 OUTLIER 41.09 68.6 2.37 Favored Pre-proline 0 C--N 1.314 -0.948 0 CA-C-N 113.149 -1.842 . . . . 0.0 112.209 173.817 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 194' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -73.1 -70.72 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.845 2.363 . . . . 0.0 112.422 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 166.56 -20.69 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.465 -179.907 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 196' ' ' THR . . . . . 0.756 ' C ' ' H ' ' B' ' 198' ' ' TYR . 0.6 OUTLIER -79.36 -20.84 0.33 Allowed Pre-proline 0 C--N 1.331 -0.198 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -179.744 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 197' ' ' PRO . . . . . 0.685 ' CD ' ' N ' ' B' ' 196' ' ' THR . 17.8 Cg_exo -64.26 25.13 0.07 OUTLIER 'Trans proline' 0 C--N 1.353 0.815 0 C-N-CA 121.218 1.279 . . . . 0.0 109.575 176.733 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 198' ' ' TYR . . . . . 0.756 ' H ' ' C ' ' B' ' 196' ' ' THR . 5.6 t80 . . . . . 0 C--O 1.248 1.022 0 CA-C-N 114.372 -1.285 . . . . 0.0 111.346 -178.74 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 1' ' ' ILE . . . . . 0.654 HD13 ' N ' ' A' ' 1' ' ' ILE . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.375 0 CA-C-O 120.989 0.423 . . . . 0.0 111.131 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 9.9 m -132.38 -179.56 3.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.351 179.496 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 7.9 t -135.16 118.09 16.29 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.594 -0.442 . . . . 0.0 112.114 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' HIS . . . . . 0.443 ' CG ' ' HB3' ' A' ' 64' ' ' LYS . 1.0 OUTLIER -35.07 143.55 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.343 179.356 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.445 HG22 ' H ' ' A' ' 6' ' ' THR . 0.2 OUTLIER -57.34 -164.23 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.47 -179.306 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.445 ' H ' HG22 ' A' ' 5' ' ' THR . 13.9 t -90.6 42.64 1.11 Allowed 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 112.295 0.479 . . . . 0.0 112.295 -178.778 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.62 ' HB1' ' HG2' ' B' ' 194' ' ' PRO . . . -150.52 -178.6 6.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.53 0.205 . . . . 0.0 111.003 179.312 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.561 HG21 ' HG3' ' B' ' 197' ' ' PRO . 0.5 OUTLIER . . . . . 0 CA--C 1.539 0.529 0 CA-C-N 116.687 -0.233 . . . . 0.0 110.966 -179.521 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.628 ' N ' ' HD2' ' A' ' 18' ' ' PRO . 77.9 Cg_exo . . . . . 0 CA--C 1.532 0.391 0 N-CA-C 113.461 0.523 . . . . 0.0 113.461 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.628 ' HD2' ' N ' ' A' ' 17' ' ' PRO . 5.7 Cg_endo -48.97 -177.49 0.01 OUTLIER 'Trans proline' 0 C--N 1.351 0.685 0 C-N-CA 122.527 2.152 . . . . 0.0 112.766 -179.209 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.406 ' O ' ' CB ' ' A' ' 20' ' ' GLU . . . -42.25 91.03 0.01 OUTLIER Glycine 0 C--N 1.334 0.452 0 CA-C-N 116.0 -0.546 . . . . 0.0 113.164 -179.606 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.439 ' N ' ' O ' ' A' ' 18' ' ' PRO . 1.6 mt-10 162.95 -173.46 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 122.595 0.358 . . . . 0.0 110.2 -179.87 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 8.1 m-20 -178.94 -79.47 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.806 0.336 . . . . 0.0 111.194 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.703 HD21 ' N ' ' A' ' 60' ' ' CYS . 3.5 tm? -59.05 91.72 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.316 -179.725 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.547 ' HA ' ' HA ' ' A' ' 44' ' ' CYS . 4.6 t -66.02 63.06 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 120.738 0.304 . . . . 0.0 111.272 179.828 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.526 ' N ' HD13 ' A' ' 22' ' ' LEU . 6.7 p90 -47.88 145.27 3.0 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.019 0.438 . . . . 0.0 111.933 -179.62 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.26 137.76 37.8 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.485 179.744 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -78.25 150.48 33.4 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.955 -179.886 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' MET . . . . . 0.432 ' O ' ' N ' ' A' ' 29' ' ' CYS . 14.7 ptm -143.54 79.29 1.63 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.976 179.885 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' TRP . . . . . 0.412 ' O ' ' HA2' ' A' ' 37' ' ' GLY . 69.2 t-105 -58.63 79.77 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.341 -179.831 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' CYS . . . . . 0.432 ' N ' ' O ' ' A' ' 27' ' ' MET . 0.5 OUTLIER -170.02 119.02 0.6 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.074 179.762 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.79 -162.01 0.59 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.77 179.949 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -56.37 -38.13 71.01 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.328 -179.936 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 27.3 m-85 -102.96 -79.17 0.53 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.921 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.477 ' O ' ' N ' ' A' ' 35' ' ' SER . 19.5 p 38.22 30.77 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 112.208 0.447 . . . . 0.0 112.208 179.773 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.3 m 48.46 -86.9 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 116.594 -0.276 . . . . 0.0 111.392 -179.989 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.477 ' N ' ' O ' ' A' ' 33' ' ' CYS . 97.6 p -176.49 71.23 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.787 0.327 . . . . 0.0 110.841 179.803 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 20.8 mtt180 -115.05 -87.93 0.58 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.1 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.412 ' HA2' ' O ' ' A' ' 28' ' ' TRP . . . 51.6 23.32 9.63 Favored Glycine 0 C--N 1.334 0.431 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.996 179.883 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.565 ' CB ' ' HG3' ' A' ' 70' ' ' LYS . 0.0 OUTLIER . . . . . 0 CA--C 1.532 0.28 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 -179.422 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' GLY . . . . . 0.495 ' HA3' ' CE1' ' A' ' 24' ' ' TYR . . . . . . . . 0 N--CA 1.45 -0.385 0 N-CA-C 113.522 0.169 . . . . 0.0 113.522 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.547 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 0.0 OUTLIER 70.41 99.53 0.06 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.239 0.543 . . . . 0.0 111.277 -179.263 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -128.4 -139.49 0.24 Allowed 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 115.342 -0.845 . . . . 0.0 110.09 179.747 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -167.98 36.53 0.03 OUTLIER 'General case' 0 C--N 1.334 -0.1 0 O-C-N 122.253 -0.28 . . . . 0.0 111.658 179.772 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 6.8 t -176.81 40.89 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 120.99 -0.284 . . . . 0.0 111.718 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 63.5 m 39.24 73.23 0.83 Allowed Pre-proline 0 N--CA 1.466 0.355 0 CA-C-N 116.731 -0.213 . . . . 0.0 111.538 179.712 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.44 ' HG2' ' HB2' ' A' ' 24' ' ' TYR . 10.6 Cg_endo -53.14 -19.08 11.32 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.128 1.886 . . . . 0.0 110.847 178.601 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.439 ' HB2' ' HA ' ' A' ' 58' ' ' THR . 39.5 t -38.24 -74.19 0.04 OUTLIER 'General case' 0 N--CA 1.457 -0.088 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.983 179.347 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 23.3 mmtt 67.89 -161.87 0.21 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.581 -179.705 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.599 ' CB ' ' CD ' ' A' ' 53' ' ' PRO . 9.5 mmmt -96.6 -163.72 0.05 OUTLIER Pre-proline 0 CA--C 1.539 0.533 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.617 -179.522 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' PRO . . . . . 0.599 ' CD ' ' CB ' ' A' ' 52' ' ' LYS . 35.5 Cg_exo -39.98 -28.3 0.25 Allowed 'Trans proline' 0 C--N 1.356 0.945 0 C-N-CA 122.644 2.229 . . . . 0.0 114.484 -178.587 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' TYR . . . . . 0.456 ' CZ ' ' HB2' ' A' ' 52' ' ' LYS . 0.1 OUTLIER . . . . . 0 N--CA 1.474 0.767 0 C-N-CA 120.556 -0.458 . . . . 0.0 111.422 -179.723 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.439 ' HA ' ' HB2' ' A' ' 50' ' ' SER . 0.0 OUTLIER . . . . . 0 CA--C 1.529 0.145 0 N-CA-C 110.412 -0.218 . . . . 0.0 110.412 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' CYS . . . . . 0.457 ' HA ' HD11 ' A' ' 22' ' ' LEU . 1.6 t -50.63 105.79 0.11 Allowed 'General case' 0 C--O 1.232 0.183 0 CA-C-O 121.025 0.44 . . . . 0.0 110.239 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.703 ' N ' HD21 ' A' ' 22' ' ' LEU . 0.5 OUTLIER -78.31 -97.04 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 115.902 -0.59 . . . . 0.0 112.315 -178.522 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.502 ' N ' HD22 ' A' ' 22' ' ' LEU . 13.1 t 39.1 88.18 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 111.608 0.225 . . . . 0.0 111.608 -179.516 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.513 HG23 ' H ' ' A' ' 63' ' ' ASP . 0.7 OUTLIER 175.75 -59.49 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 111.791 0.293 . . . . 0.0 111.791 179.983 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ASP . . . . . 0.513 ' H ' HG23 ' A' ' 62' ' ' THR . 8.6 m-20 -130.76 -158.8 0.92 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.784 0.326 . . . . 0.0 111.381 -179.251 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.443 ' HB3' ' CG ' ' A' ' 4' ' ' HIS . 0.7 OUTLIER -77.49 -2.43 35.44 Favored 'General case' 0 N--CA 1.461 0.124 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.975 -179.467 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 56.1 m 36.02 42.26 0.16 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.952 -0.567 . . . . 0.0 112.354 179.39 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.405 ' N ' ' HD3' ' A' ' 67' ' ' PRO . 2.3 m-80 -133.4 53.03 9.5 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 120.695 0.283 . . . . 0.0 111.491 179.965 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' PRO . . . . . 0.405 ' HD3' ' N ' ' A' ' 66' ' ' ASN . 96.1 Cg_endo -79.81 -167.55 0.52 Allowed 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.534 2.156 . . . . 0.0 112.184 179.532 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 41.8 m80 -68.97 112.1 10.49 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.671 179.802 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_exo -60.9 -67.14 0.05 OUTLIER 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.476 2.117 . . . . 0.0 112.517 -179.536 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.565 ' HG3' ' CB ' ' A' ' 38' ' ' LYS . 1.0 OUTLIER -73.76 145.97 44.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.011 0.434 . . . . 0.0 111.087 -179.71 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.328 -0.36 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.212 -179.715 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 192' ' ' CYS . . . . . 0.685 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.0 OUTLIER . . . . . 0 CA--C 1.498 -1.034 0 CA-C-O 122.132 0.968 . . . . 0.0 111.399 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 193' ' ' CYS . . . . . 0.686 ' N ' ' HD3' ' B' ' 194' ' ' PRO . 0.1 OUTLIER 38.61 48.09 1.5 Allowed Pre-proline 0 C--N 1.314 -0.942 0 CA-C-N 112.995 -1.911 . . . . 0.0 112.843 174.12 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 194' ' ' PRO . . . . . 0.686 ' HD3' ' N ' ' B' ' 193' ' ' CYS . 57.3 Cg_endo -100.67 -69.6 0.0 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.966 0 C-N-CA 123.602 2.868 . . . . 0.0 112.838 -179.452 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -70.46 -84.75 0.03 OUTLIER 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.153 -0.476 . . . . 0.0 112.012 -179.131 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 196' ' ' THR . . . . . 0.629 ' C ' ' H ' ' B' ' 198' ' ' TYR . 10.2 t -160.17 52.04 0.43 Allowed Pre-proline 0 C--N 1.332 -0.16 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 -179.089 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 197' ' ' PRO . . . . . 0.6 ' HD3' ' N ' ' B' ' 196' ' ' THR . 2.6 Cg_exo -73.08 15.89 0.46 Allowed 'Trans proline' 0 N--CA 1.459 -0.514 0 C-N-CA 121.879 1.72 . . . . 0.0 108.73 175.848 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 198' ' ' TYR . . . . . 0.629 ' H ' ' C ' ' B' ' 196' ' ' THR . 51.4 t80 . . . . . 0 C--O 1.25 1.079 0 CA-C-N 113.939 -1.482 . . . . 0.0 111.176 -178.6 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 24.5 mm . . . . . 0 N--CA 1.486 1.355 0 CA-C-O 120.789 0.328 . . . . 0.0 111.068 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' VAL . . . . . 0.591 HG22 ' H ' ' A' ' 3' ' ' CYS . 0.5 OUTLIER -155.0 -176.18 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.901 179.872 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.591 ' H ' HG22 ' A' ' 2' ' ' VAL . 21.6 m -103.45 -174.63 2.59 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.147 0.499 . . . . 0.0 111.561 -179.537 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 4' ' ' HIS . . . . . 0.473 ' O ' ' N ' ' A' ' 6' ' ' THR . 0.9 OUTLIER -139.53 97.59 3.31 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.925 179.307 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.1 m 28.63 36.78 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 114.673 -1.149 . . . . 0.0 112.71 -179.736 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.546 HG22 ' O ' ' A' ' 6' ' ' THR . 21.0 m 48.94 21.67 0.49 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.604 0.24 . . . . 0.0 111.624 -179.813 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 44.61 30.07 0.48 Allowed 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 120.756 0.313 . . . . 0.0 111.51 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 30.2 m . . . . . 0 C--N 1.33 -0.252 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.864 -179.824 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo . . . . . 0 C--O 1.233 0.225 0 CA-C-O 120.682 0.201 . . . . 0.0 112.297 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -63.58 161.21 32.66 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.509 2.139 . . . . 0.0 112.214 179.884 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 46.78 70.85 0.61 Allowed Glycine 0 CA--C 1.518 0.23 0 C-N-CA 120.957 -0.639 . . . . 0.0 112.66 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -151.2 -177.28 5.95 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.894 0.378 . . . . 0.0 111.046 -179.785 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ASN . . . . . 0.671 ' HB3' ' HB3' ' A' ' 45' ' ' ALA . 0.8 OUTLIER -107.25 69.59 0.76 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.959 -179.954 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.466 ' HB3' ' H ' ' A' ' 23' ' ' CYS . 0.2 OUTLIER 49.88 -96.41 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.795 -0.639 . . . . 0.0 112.256 179.585 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.602 ' C ' ' H ' ' A' ' 44' ' ' CYS . 0.9 OUTLIER -158.66 30.76 0.23 Allowed 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 113.268 0.84 . . . . 0.0 113.268 -178.485 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.548 ' CE1' ' HA ' ' A' ' 58' ' ' THR . 0.1 OUTLIER 55.07 161.21 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 118.2 0.454 . . . . 0.0 110.788 178.624 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -150.93 63.32 0.92 Allowed 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.503 0.557 . . . . 0.0 112.503 179.841 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -51.02 132.93 27.69 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.087 0.47 . . . . 0.0 111.62 179.853 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 2.7 ptp -152.96 110.34 3.53 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.342 179.578 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' TRP . . . . . 0.414 ' O ' ' N ' ' A' ' 30' ' ' ASP . 26.4 t90 -79.89 -78.77 0.16 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.583 -179.314 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' CYS . . . . . 0.443 ' O ' ' O ' ' A' ' 30' ' ' ASP . 2.4 t 52.62 -89.98 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.303 -178.995 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.443 ' O ' ' O ' ' A' ' 29' ' ' CYS . 82.9 m-20 44.93 -177.31 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 120.953 0.406 . . . . 0.0 111.894 179.223 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . 39.45 -145.72 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.405 179.757 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -92.49 44.72 1.17 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.872 0.367 . . . . 0.0 110.889 179.707 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 6.2 p -55.66 125.49 21.37 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.796 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 2.8 m -48.22 -52.94 18.78 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.513 -179.679 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.428 ' CB ' ' HB2' ' A' ' 70' ' ' LYS . 1.3 m -137.79 166.96 22.72 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.041 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 2.5 mtm-85 -89.32 108.66 19.75 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.899 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.402 ' N ' ' HB3' ' A' ' 70' ' ' LYS . . . 163.46 -163.54 35.69 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.404 -0.903 . . . . 0.0 112.579 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.436 ' HB2' ' HG2' ' A' ' 70' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.294 0 CA-C-O 120.686 0.279 . . . . 0.0 110.702 -179.816 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.555 0 N-CA-C 114.358 0.503 . . . . 0.0 114.358 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.602 ' H ' ' C ' ' A' ' 23' ' ' CYS . 87.6 m 58.69 114.93 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 117.128 0.464 . . . . 0.0 111.611 179.122 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.671 ' HB3' ' HB3' ' A' ' 21' ' ' ASN . . . -85.84 169.65 13.14 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.964 179.639 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -110.34 -39.28 5.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.821 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.702 HG23 ' CD ' ' A' ' 49' ' ' PRO . 11.7 t -138.53 164.3 29.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.112 179.724 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.615 ' N ' ' HD3' ' A' ' 49' ' ' PRO . 0.9 OUTLIER -132.59 44.45 1.33 Allowed Pre-proline 0 CA--C 1.532 0.254 0 N-CA-C 112.762 0.652 . . . . 0.0 112.762 -179.077 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.702 ' CD ' HG23 ' A' ' 47' ' ' THR . 55.4 Cg_endo -91.43 18.38 1.22 Allowed 'Trans proline' 0 N--CA 1.455 -0.789 0 C-N-CA 122.517 2.144 . . . . 0.0 110.518 177.817 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.462 ' O ' ' CD ' ' A' ' 52' ' ' LYS . 9.8 t -105.71 -112.99 0.26 Allowed 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 115.283 -0.871 . . . . 0.0 111.427 -178.412 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.436 ' CG ' ' O ' ' A' ' 50' ' ' SER . 0.6 OUTLIER 51.99 24.94 2.85 Favored 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 122.437 0.295 . . . . 0.0 111.681 -179.847 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.711 ' HB2' ' HD3' ' A' ' 53' ' ' PRO . 0.3 OUTLIER -143.3 -54.19 0.02 OUTLIER Pre-proline 0 CA--C 1.533 0.301 0 N-CA-C 111.935 0.346 . . . . 0.0 111.935 179.527 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 53' ' ' PRO . . . . . 0.711 ' HD3' ' HB2' ' A' ' 52' ' ' LYS . 15.3 Cg_exo -69.3 153.62 70.76 Favored 'Trans proline' 0 C--N 1.35 0.639 0 C-N-CA 122.253 1.969 . . . . 0.0 112.565 -179.633 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.468 0.439 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.505 179.777 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.548 ' HA ' ' CE1' ' A' ' 24' ' ' TYR . 0.2 OUTLIER . . . . . 0 CA--C 1.52 -0.186 0 CA-C-O 120.422 0.153 . . . . 0.0 110.902 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' CYS . . . . . 0.479 ' SG ' ' O ' ' A' ' 58' ' ' THR . 15.4 m -167.94 158.51 10.65 Favored 'General case' 0 CA--C 1.528 0.117 0 CA-C-O 121.741 0.781 . . . . 0.0 112.814 179.716 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.44 ' O ' ' HB2' ' A' ' 22' ' ' LEU . 0.2 OUTLIER 170.47 129.35 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 114.241 -1.345 . . . . 0.0 109.159 178.646 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.456 ' HA ' ' CG ' ' A' ' 22' ' ' LEU . 16.1 p -176.78 170.55 2.34 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.916 0.388 . . . . 0.0 111.336 -179.238 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER 48.73 38.2 11.2 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.45 179.803 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 179.01 -174.64 0.19 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.769 179.813 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.512 ' HE3' HG12 ' A' ' 2' ' ' VAL . 12.8 mmtm -101.91 17.99 21.73 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.221 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' CYS . . . . . 0.417 ' HB2' ' O ' ' A' ' 64' ' ' LYS . 56.3 m 68.25 -49.62 0.55 Allowed 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 112.361 0.504 . . . . 0.0 112.361 179.499 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.476 ' O ' ' ND2' ' A' ' 66' ' ' ASN . 0.2 OUTLIER -32.53 98.18 0.12 Allowed Pre-proline 0 N--CA 1.469 0.522 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 -179.728 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -83.72 -101.73 0.0 OUTLIER 'Trans proline' 0 CA--C 1.536 0.598 0 C-N-CA 122.708 2.272 . . . . 0.0 112.348 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.408 ' HA ' ' HD3' ' A' ' 69' ' ' PRO . 1.8 t-80 175.47 132.08 0.15 Allowed Pre-proline 0 CA--C 1.531 0.228 0 O-C-N 122.343 -0.223 . . . . 0.0 110.875 179.836 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 68' ' ' HIS . 33.6 Cg_exo -59.97 155.22 45.62 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.511 2.141 . . . . 0.0 112.41 179.9 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.436 ' HG2' ' HB2' ' A' ' 38' ' ' LYS . 0.0 OUTLIER -97.5 -34.31 11.05 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.754 179.609 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.331 -0.215 0 CA-C-O 120.904 0.383 . . . . 0.0 110.725 179.725 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 192' ' ' CYS . . . . . 0.698 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.0 OUTLIER . . . . . 0 CA--C 1.499 -1.009 0 CA-C-O 121.629 0.728 . . . . 0.0 111.559 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 193' ' ' CYS . . . . . 0.698 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.0 OUTLIER 46.96 112.95 0.0 OUTLIER Pre-proline 0 C--N 1.315 -0.933 0 CA-C-N 113.552 -1.658 . . . . 0.0 112.512 173.636 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 194' ' ' PRO . . . . . . . . . . . . . 80.3 Cg_exo -42.22 162.88 0.04 OUTLIER 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.709 2.273 . . . . 0.0 112.622 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -94.34 -15.23 24.58 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.792 -179.45 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 196' ' ' THR . . . . . 0.551 ' C ' ' H ' ' B' ' 198' ' ' TYR . 27.3 p -122.02 40.3 0.44 Allowed Pre-proline 0 C--N 1.331 -0.235 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 197' ' ' PRO . . . . . 0.544 ' CD ' ' N ' ' B' ' 196' ' ' THR . 94.2 Cg_endo -76.25 15.39 0.99 Allowed 'Trans proline' 0 N--CA 1.458 -0.59 0 C-N-CA 121.757 1.638 . . . . 0.0 108.906 176.123 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 198' ' ' TYR . . . . . 0.551 ' H ' ' C ' ' B' ' 196' ' ' THR . 46.5 t80 . . . . . 0 C--O 1.249 1.066 0 CA-C-N 113.947 -1.479 . . . . 0.0 111.338 -178.811 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 1' ' ' ILE . . . . . 0.525 HG23 ' HA ' ' A' ' 62' ' ' THR . 27.4 mm . . . . . 0 N--CA 1.486 1.352 0 CA-C-O 120.761 0.315 . . . . 0.0 111.026 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 2' ' ' VAL . . . . . 0.585 HG13 ' CE1' ' A' ' 4' ' ' HIS . 8.2 p -176.9 150.02 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.876 -179.908 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.483 ' C ' ' CG ' ' A' ' 4' ' ' HIS . 3.8 p -111.99 -28.12 8.15 Favored 'General case' 0 C--O 1.224 -0.252 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 -179.193 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 4' ' ' HIS . . . . . 0.585 ' CE1' HG13 ' A' ' 2' ' ' VAL . 0.0 OUTLIER 57.67 162.27 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.892 0.377 . . . . 0.0 110.682 -179.495 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.4 m -96.4 35.93 1.42 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.485 -179.641 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.473 ' HB ' ' HB2' ' A' ' 66' ' ' ASN . 24.0 m -37.75 -34.5 0.11 Allowed 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.135 -179.919 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.523 ' C ' HG23 ' A' ' 8' ' ' THR . . . 34.79 80.66 0.02 OUTLIER 'General case' 0 N--CA 1.461 0.084 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.316 179.745 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.523 HG23 ' C ' ' A' ' 7' ' ' ALA . 1.9 p . . . . . 0 C--N 1.33 -0.252 0 CA-C-N 115.749 -0.659 . . . . 0.0 111.236 -179.546 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.56 ' N ' ' CD ' ' A' ' 18' ' ' PRO . 61.6 Cg_endo . . . . . 0 CA--C 1.541 0.839 0 N-CA-C 115.284 1.225 . . . . 0.0 115.284 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.56 ' CD ' ' N ' ' A' ' 17' ' ' PRO . 89.2 Cg_endo -82.96 -168.39 0.58 Allowed 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 121.659 1.572 . . . . 0.0 112.111 179.807 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -65.03 79.4 0.07 OUTLIER Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.55 -0.834 . . . . 0.0 111.967 179.669 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 66.42 118.08 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.903 0.382 . . . . 0.0 110.436 -179.47 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ASN . . . . . 0.467 ' O ' ' HB2' ' A' ' 22' ' ' LEU . 1.7 t-20 -146.05 -63.21 0.32 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.668 -179.735 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.773 HD13 ' HB3' ' A' ' 61' ' ' SER . 2.4 mm? 70.7 108.72 0.06 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.276 179.586 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.587 ' HA ' ' HA ' ' A' ' 44' ' ' CYS . 5.5 m -64.08 65.34 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 115.901 -0.591 . . . . 0.0 111.639 -179.784 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.57 ' CG ' ' HB2' ' A' ' 45' ' ' ALA . 0.1 OUTLIER -22.72 138.1 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 123.54 0.736 . . . . 0.0 112.639 179.985 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -128.29 110.38 12.33 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.536 -179.683 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 1.5 ptpt -114.14 114.28 25.84 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.298 179.265 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -137.49 97.59 3.5 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.975 0.417 . . . . 0.0 111.272 -179.656 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -70.21 -165.8 0.11 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.741 179.453 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' CYS . . . . . 0.449 ' HB3' ' HA ' ' A' ' 33' ' ' CYS . 0.0 OUTLIER -132.22 -167.53 1.9 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.863 -179.249 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -90.31 -49.64 6.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.174 -179.816 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -155.5 -75.31 0.1 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.382 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.406 ' O ' ' CD2' ' A' ' 32' ' ' PHE . 33.7 t80 -90.44 14.08 13.94 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.42 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.449 ' HA ' ' HB3' ' A' ' 29' ' ' CYS . 93.9 m 48.84 79.67 0.07 Allowed 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.771 0.32 . . . . 0.0 111.088 -179.899 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 5.6 p -135.16 42.7 2.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.041 -179.831 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 60.84 35.22 19.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.014 179.831 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -129.76 31.08 4.79 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.871 179.889 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -104.81 -168.7 24.34 Favored Glycine 0 C--N 1.331 0.266 0 C-N-CA 120.83 -0.7 . . . . 0.0 112.643 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.243 0 CA-C-O 120.737 0.303 . . . . 0.0 111.048 -179.89 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.52 0.383 0 N-CA-C 114.407 0.523 . . . . 0.0 114.407 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.587 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 0.0 OUTLIER 57.32 157.87 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 117.373 0.587 . . . . 0.0 112.327 178.612 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.585 ' O ' ' HB3' ' A' ' 46' ' ' ALA . . . -151.11 -39.27 0.12 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.465 -0.788 . . . . 0.0 111.466 -179.718 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.585 ' HB3' ' O ' ' A' ' 45' ' ' ALA . . . 80.85 40.52 0.06 Allowed 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.975 -179.766 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.431 HG23 ' O ' ' A' ' 47' ' ' THR . 4.6 t -165.77 77.48 0.26 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.67 179.786 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.542 ' N ' ' HD2' ' A' ' 49' ' ' PRO . 52.9 t -69.07 -48.88 26.74 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.417 -179.737 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.542 ' HD2' ' N ' ' A' ' 48' ' ' CYS . 52.0 Cg_endo -69.89 58.95 1.66 Allowed 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 121.705 1.603 . . . . 0.0 110.04 178.628 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.426 ' N ' ' O ' ' A' ' 48' ' ' CYS . 42.8 t -110.0 -109.01 0.34 Allowed 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 114.977 -1.01 . . . . 0.0 111.057 -178.159 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.41 ' HG3' ' O ' ' A' ' 50' ' ' SER . 0.4 OUTLIER 36.17 77.54 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.323 0 N-CA-C 112.149 0.425 . . . . 0.0 112.149 179.808 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.55 ' HB2' ' HD3' ' A' ' 53' ' ' PRO . 0.0 OUTLIER -104.26 -56.4 0.09 OUTLIER Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.611 179.366 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 53' ' ' PRO . . . . . 0.55 ' HD3' ' HB2' ' A' ' 52' ' ' LYS . 11.8 Cg_endo -93.29 171.23 2.07 Favored 'Trans proline' 0 N--CA 1.453 -0.908 0 C-N-CA 123.167 2.578 . . . . 0.0 111.749 179.69 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.469 0.487 0 CA-C-O 120.842 0.353 . . . . 0.0 110.722 179.8 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 89.0 m . . . . . 0 N--CA 1.454 -0.266 0 CA-C-O 120.655 0.264 . . . . 0.0 111.013 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 59' ' ' CYS . . . . . 0.42 ' HB2' ' HG ' ' A' ' 22' ' ' LEU . 0.6 OUTLIER -43.44 133.75 4.2 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.89 179.773 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.571 ' HB2' ' O ' ' A' ' 23' ' ' CYS . 0.5 OUTLIER -114.97 -94.58 0.47 Allowed 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.905 -178.846 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.773 ' HB3' HD13 ' A' ' 22' ' ' LEU . 2.3 t 64.07 -76.48 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.79 0.329 . . . . 0.0 111.567 -179.848 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.525 ' HA ' HG23 ' A' ' 1' ' ' ILE . 9.3 t -44.22 134.05 5.07 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.135 -0.484 . . . . 0.0 112.044 -179.054 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 56.17 173.15 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.718 -0.673 . . . . 0.0 111.586 179.384 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.75 84.75 0.11 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.039 179.605 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -93.37 16.96 12.15 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.074 -0.512 . . . . 0.0 112.311 -178.705 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.481 ' OD1' ' CD2' ' A' ' 4' ' ' HIS . 0.2 OUTLIER -54.04 163.16 1.25 Allowed Pre-proline 0 N--CA 1.465 0.275 0 CA-C-O 120.908 0.385 . . . . 0.0 111.15 179.841 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_exo -51.25 124.89 15.04 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.709 2.273 . . . . 0.0 112.307 179.78 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 11.8 m-70 -133.75 99.78 13.83 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.856 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -48.81 165.66 0.17 Allowed 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.571 2.181 . . . . 0.0 112.46 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.8 ptmt -114.83 -30.1 6.54 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.976 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 . . . . . 0 C--N 1.33 -0.247 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.37 179.866 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 192' ' ' CYS . . . . . 0.705 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.1 OUTLIER . . . . . 0 CA--C 1.5 -0.944 0 CA-C-O 121.506 0.67 . . . . 0.0 112.149 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 193' ' ' CYS . . . . . 0.705 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.0 OUTLIER -162.45 163.37 18.36 Favored Pre-proline 0 N--CA 1.436 -1.161 0 CA-C-N 114.278 -1.328 . . . . 0.0 111.752 -173.46 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 194' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -82.74 130.99 6.07 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.768 2.312 . . . . 0.0 112.051 179.604 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -63.84 80.81 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.02 -179.908 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 196' ' ' THR . . . . . 0.687 ' N ' ' CD ' ' B' ' 197' ' ' PRO . 0.7 OUTLIER -118.34 5.43 0.08 OUTLIER Pre-proline 0 C--N 1.328 -0.328 0 N-CA-C 113.763 1.023 . . . . 0.0 113.763 -179.636 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 197' ' ' PRO . . . . . 0.687 ' CD ' ' N ' ' B' ' 196' ' ' THR . 73.9 Cg_endo -74.04 21.93 0.37 Allowed 'Trans proline' 0 C--N 1.354 0.827 0 CA-C-N 120.53 1.225 . . . . 0.0 109.042 176.471 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 198' ' ' TYR . . . . . 0.646 ' H ' ' C ' ' B' ' 196' ' ' THR . 0.2 OUTLIER . . . . . 0 C--O 1.25 1.081 0 CA-C-N 114.058 -1.428 . . . . 0.0 111.379 -178.753 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 1' ' ' ILE . . . . . 0.579 HD13 ' N ' ' A' ' 1' ' ' ILE . 0.1 OUTLIER . . . . . 0 N--CA 1.485 1.313 0 CA-C-O 120.94 0.4 . . . . 0.0 111.132 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 2' ' ' VAL . . . . . 0.428 ' O ' ' HA ' ' A' ' 64' ' ' LYS . 3.7 m -98.98 -171.02 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.735 179.751 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -148.14 88.33 1.65 Allowed 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 111.773 0.286 . . . . 0.0 111.773 -179.667 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 4' ' ' HIS . . . . . 0.494 ' CE1' ' HB2' ' A' ' 64' ' ' LYS . 4.9 p-80 -59.0 126.79 29.17 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.888 0.375 . . . . 0.0 110.23 179.299 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 75.0 p -47.21 -74.7 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.483 -179.395 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 63.8 p 50.45 23.82 1.39 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.928 179.656 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -120.38 -161.12 0.86 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.564 -0.289 . . . . 0.0 110.327 179.436 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 1.3 t . . . . . 0 N--CA 1.462 0.146 0 CA-C-O 120.869 0.366 . . . . 0.0 110.066 179.45 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_exo . . . . . 0 CA--C 1.529 0.263 0 N-CA-C 113.018 0.353 . . . . 0.0 113.018 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_exo -57.17 -160.25 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.724 2.283 . . . . 0.0 112.475 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 64.17 -86.67 0.07 OUTLIER Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.675 -0.774 . . . . 0.0 112.137 -179.809 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -105.07 142.32 35.06 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 110.252 -0.277 . . . . 0.0 110.252 179.53 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ASN . . . . . 0.408 ' HB3' ' N ' ' A' ' 45' ' ' ALA . 1.5 m-20 64.14 88.86 0.1 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.437 -179.617 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.466 ' HG ' ' CB ' ' A' ' 61' ' ' SER . 0.6 OUTLIER -73.66 -80.32 0.07 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.478 -179.49 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 8.4 m -158.52 29.04 0.23 Allowed 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 120.602 0.239 . . . . 0.0 111.546 -178.983 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.769 ' CD1' ' HB3' ' A' ' 45' ' ' ALA . 0.0 OUTLIER -83.49 161.93 21.09 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.075 0.464 . . . . 0.0 111.728 -178.973 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.469 ' N ' ' CG ' ' A' ' 24' ' ' TYR . 0.9 OUTLIER -168.73 -79.08 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 115.718 -0.673 . . . . 0.0 110.973 178.889 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 177.7 165.97 0.66 Allowed 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.646 0.26 . . . . 0.0 110.767 179.844 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -152.09 -167.18 2.69 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.143 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' TRP . . . . . 0.421 ' HA ' ' CE3' ' A' ' 28' ' ' TRP . 2.5 t-105 -148.38 179.02 8.1 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.447 179.756 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -173.59 99.32 0.11 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.837 0.351 . . . . 0.0 111.117 -179.901 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 50.2 t0 -66.05 137.51 57.13 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.555 179.728 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . 59.22 -156.29 0.34 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.524 -179.751 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 14.1 m-85 -82.59 53.11 2.25 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.823 0.344 . . . . 0.0 110.904 179.785 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 56.9 m 44.95 30.06 0.53 Allowed 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.308 -179.907 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 92.3 p -82.24 -31.67 30.09 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.62 179.824 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -130.15 114.67 16.01 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.621 179.78 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 33.1 mmm-85 -57.12 133.89 55.39 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.229 -179.732 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.406 ' C ' ' HG2' ' A' ' 38' ' ' LYS . . . -113.65 44.71 1.44 Allowed Glycine 0 C--N 1.33 0.248 0 C-N-CA 120.824 -0.703 . . . . 0.0 112.586 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.428 ' O ' ' HG3' ' A' ' 70' ' ' LYS . 0.2 OUTLIER . . . . . 0 CA--C 1.531 0.223 0 C-N-CA 122.218 0.207 . . . . 0.0 111.402 179.767 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' GLY . . . . . 0.427 ' N ' ' HB2' ' A' ' 25' ' ' ARG . . . . . . . . 0 N--CA 1.45 -0.388 0 N-CA-C 112.736 -0.146 . . . . 0.0 112.736 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.434 ' O ' ' HB2' ' A' ' 45' ' ' ALA . 3.3 m 62.65 147.62 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.897 0.38 . . . . 0.0 111.333 179.249 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.769 ' HB3' ' CD1' ' A' ' 24' ' ' TYR . . . 175.97 137.3 0.05 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.769 179.345 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -70.27 67.96 0.33 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.051 0.453 . . . . 0.0 110.795 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.816 HG22 ' HD3' ' A' ' 49' ' ' PRO . 89.0 m -164.77 147.09 8.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.817 -179.62 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -131.6 67.3 79.79 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.899 179.928 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.816 ' HD3' HG22 ' A' ' 47' ' ' THR . 32.6 Cg_exo -60.94 -11.22 17.22 Favored 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 122.466 2.111 . . . . 0.0 111.659 178.943 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 32.4 t -39.33 -68.7 0.15 Allowed 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 115.598 -0.728 . . . . 0.0 112.336 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 16.6 ptmt -90.69 77.16 6.37 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 120.923 0.392 . . . . 0.0 111.718 -179.238 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.624 ' HB3' ' CD ' ' A' ' 53' ' ' PRO . 0.6 OUTLIER -148.34 -167.11 0.15 Allowed Pre-proline 0 CA--C 1.538 0.494 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 179.682 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 53' ' ' PRO . . . . . 0.624 ' CD ' ' HB3' ' A' ' 52' ' ' LYS . 76.0 Cg_exo -51.96 -142.33 0.0 OUTLIER 'Trans proline' 0 C--N 1.356 0.947 0 C-N-CA 122.445 2.097 . . . . 0.0 113.198 -179.461 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.471 0.585 0 CA-C-O 120.83 0.347 . . . . 0.0 111.782 -179.059 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 10.7 p . . . . . 0 C--O 1.232 0.14 0 CA-C-O 120.974 0.416 . . . . 0.0 110.14 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 59' ' ' CYS . . . . . 0.565 ' O ' ' CB ' ' A' ' 60' ' ' CYS . 80.4 m 56.06 -116.51 1.02 Allowed 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.802 -179.316 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.565 ' CB ' ' O ' ' A' ' 59' ' ' CYS . 2.4 m 139.17 47.07 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.476 0.71 . . . . 0.0 109.889 179.401 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.466 ' CB ' ' HG ' ' A' ' 22' ' ' LEU . 79.3 p -115.73 160.55 19.94 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.334 -179.424 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 1.3 m 73.84 17.68 3.51 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.934 -0.576 . . . . 0.0 111.635 179.732 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.9 p30 171.18 167.93 0.08 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 120.687 0.28 . . . . 0.0 110.909 179.71 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.494 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 0.0 OUTLIER -56.96 -32.79 66.39 Favored 'General case' 0 CA--C 1.516 -0.352 0 CA-C-O 121.498 0.666 . . . . 0.0 110.913 179.827 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 65' ' ' CYS . . . . . 0.408 ' HB3' ' O ' ' A' ' 64' ' ' LYS . 43.6 t 72.32 -44.36 0.59 Allowed 'General case' 0 C--N 1.313 -0.986 0 CA-C-N 114.727 -1.124 . . . . 0.0 112.689 179.03 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.455 ' HB2' ' NE2' ' A' ' 4' ' ' HIS . 0.3 OUTLIER -40.07 97.35 0.13 Allowed Pre-proline 0 N--CA 1.47 0.543 0 CA-C-O 120.697 0.284 . . . . 0.0 111.532 -178.92 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 67' ' ' PRO . . . . . 0.459 ' O ' ' CG ' ' A' ' 68' ' ' HIS . 6.7 Cg_exo -73.88 -2.24 11.96 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.953 2.435 . . . . 0.0 112.711 -179.98 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.459 ' CG ' ' O ' ' A' ' 67' ' ' PRO . 3.4 p80 55.98 168.49 0.05 OUTLIER Pre-proline 0 CA--C 1.53 0.202 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.085 -179.824 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 77.2 Cg_exo -50.53 114.42 1.45 Allowed 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.531 2.154 . . . . 0.0 112.325 -179.869 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.428 ' HG3' ' O ' ' A' ' 38' ' ' LYS . 2.3 mtmm -61.52 -61.68 2.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.948 -179.925 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.4 ' HA ' ' CD ' ' A' ' 38' ' ' LYS . 1.3 tt0 . . . . . 0 CA--C 1.533 0.291 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.349 179.745 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 192' ' ' CYS . . . . . 0.687 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.0 OUTLIER . . . . . 0 CA--C 1.496 -1.113 0 CA-C-O 121.955 0.883 . . . . 0.0 111.352 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 193' ' ' CYS . . . . . 0.687 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.1 OUTLIER 40.02 89.53 0.08 OUTLIER Pre-proline 0 N--CA 1.439 -0.983 0 CA-C-N 113.23 -1.805 . . . . 0.0 112.257 173.774 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 194' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_exo -49.07 176.93 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.61 2.206 . . . . 0.0 112.375 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -65.55 76.27 0.07 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.121 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 196' ' ' THR . . . . . 0.697 ' N ' ' HD3' ' B' ' 197' ' ' PRO . 9.7 t -150.14 45.56 0.36 Allowed Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.934 179.862 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 197' ' ' PRO . . . . . 0.697 ' HD3' ' N ' ' B' ' 196' ' ' THR . 3.7 Cg_exo -76.27 13.55 1.3 Allowed 'Trans proline' 0 C--N 1.351 0.68 0 C-N-CA 121.797 1.665 . . . . 0.0 108.572 175.894 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 198' ' ' TYR . . . . . 0.556 ' H ' ' C ' ' B' ' 196' ' ' THR . 43.6 t80 . . . . . 0 C--O 1.249 1.075 0 CA-C-N 113.766 -1.561 . . . . 0.0 111.237 -178.81 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 2.8 pp . . . . . 0 N--CA 1.486 1.369 0 CA-C-O 120.789 0.328 . . . . 0.0 111.143 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 22.5 t -144.91 148.46 17.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.55 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -97.31 -156.79 0.55 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.776 179.81 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 4' ' ' HIS . . . . . 0.508 ' CD2' ' HA ' ' A' ' 64' ' ' LYS . 2.2 p80 -123.89 151.25 43.71 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 178.745 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 42.9 p -60.14 114.17 2.73 Favored 'General case' 0 N--CA 1.439 -0.979 0 CA-C-O 121.554 0.692 . . . . 0.0 111.974 -178.43 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.598 HG22 ' O ' ' A' ' 6' ' ' THR . 64.5 m -151.39 27.95 0.65 Allowed 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 114.706 -1.134 . . . . 0.0 108.835 178.944 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -39.31 -31.7 0.09 Allowed 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 115.346 -0.843 . . . . 0.0 112.357 -179.146 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 88.1 m . . . . . 0 C--N 1.329 -0.292 0 CA-C-O 120.78 0.324 . . . . 0.0 111.209 -179.796 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_endo . . . . . 0 CA--C 1.529 0.259 0 CA-C-O 120.654 0.189 . . . . 0.0 112.471 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_exo -48.78 162.25 0.4 Allowed 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.612 2.208 . . . . 0.0 112.28 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 62.69 124.15 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.621 -0.799 . . . . 0.0 112.175 -179.782 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER 61.33 59.57 1.9 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.107 0.48 . . . . 0.0 110.655 -179.809 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 16.5 p-10 -155.29 96.05 1.77 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.53 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.409 ' O ' ' N ' ' A' ' 61' ' ' SER . 59.2 mt -112.79 28.16 9.02 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.615 -179.493 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.561 ' O ' ' HB3' ' A' ' 60' ' ' CYS . 7.8 t 37.08 67.44 0.35 Allowed 'General case' 0 C--O 1.222 -0.373 0 CA-C-N 116.6 -0.273 . . . . 0.0 111.608 179.331 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.85 ' CD2' ' HB2' ' A' ' 45' ' ' ALA . 0.0 OUTLIER -84.25 170.49 13.66 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 121.204 0.526 . . . . 0.0 112.366 -179.002 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 174.57 150.75 0.09 Allowed 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.477 -179.67 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.584 ' O ' ' CB ' ' A' ' 27' ' ' MET . 0.1 OUTLIER -144.83 -83.48 0.14 Allowed 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 120.765 -0.374 . . . . 0.0 111.821 179.996 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 27' ' ' MET . . . . . 0.584 ' CB ' ' O ' ' A' ' 26' ' ' LYS . 5.7 ptt? 134.09 -144.84 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.989 0.916 . . . . 0.0 108.692 -179.155 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -169.9 170.46 7.71 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-O 120.71 0.29 . . . . 0.0 110.892 179.179 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 18.4 t -177.38 -77.05 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.919 179.859 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 170.41 -80.76 0.0 OUTLIER 'General case' 0 CA--C 1.529 0.17 0 CA-C-O 120.676 0.274 . . . . 0.0 110.992 179.875 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -161.97 -80.98 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.189 179.937 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 35.2 p90 -97.5 21.05 10.73 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.777 0.322 . . . . 0.0 111.087 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 2.3 p -75.51 125.28 28.71 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.0 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 5.5 m -62.92 -20.81 65.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.232 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 25.7 p -87.38 50.88 2.09 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.884 0.373 . . . . 0.0 111.013 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 4.6 ptt85 -67.04 81.87 0.12 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.97 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.439 ' HA3' ' HG2' ' A' ' 70' ' ' LYS . . . 163.31 -142.18 7.68 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.678 -0.773 . . . . 0.0 112.6 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.435 ' HD2' ' CD ' ' A' ' 70' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.332 -0.157 0 CA-C-O 120.523 0.202 . . . . 0.0 111.061 -179.745 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' GLY . . . . . 0.454 ' HA2' ' O ' ' A' ' 24' ' ' TYR . . . . . . . . 0 CA--C 1.52 0.359 0 N-CA-C 113.73 0.252 . . . . 0.0 113.73 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.478 ' O ' ' CE1' ' A' ' 24' ' ' TYR . 0.5 OUTLIER 59.59 129.06 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 112.392 0.516 . . . . 0.0 112.392 179.075 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.85 ' HB2' ' CD2' ' A' ' 24' ' ' TYR . . . -140.73 -164.27 1.7 Allowed 'General case' 0 N--CA 1.461 0.103 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.176 179.921 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -132.04 20.32 4.51 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.602 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.466 HG23 ' HG2' ' A' ' 49' ' ' PRO . 1.5 m -178.58 124.07 0.1 Allowed 'General case' 0 CA--C 1.53 0.194 0 CA-C-O 120.777 0.322 . . . . 0.0 110.89 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.639 ' O ' ' N ' ' A' ' 50' ' ' SER . 47.5 t -77.83 -55.92 1.16 Allowed Pre-proline 0 C--N 1.332 -0.186 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.813 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.524 ' HD2' ' N ' ' A' ' 48' ' ' CYS . 4.0 Cg_exo -40.22 81.76 0.01 OUTLIER 'Trans proline' 0 C--N 1.356 0.967 0 C-N-CA 122.627 2.218 . . . . 0.0 111.411 179.842 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.639 ' N ' ' O ' ' A' ' 48' ' ' CYS . 41.1 t -131.25 8.31 4.68 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.296 -0.865 . . . . 0.0 111.541 -178.083 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 8.9 mtmt -61.93 -19.2 62.46 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.236 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.575 ' HB3' ' HD2' ' A' ' 53' ' ' PRO . 0.0 OUTLIER -57.15 179.64 0.13 Allowed Pre-proline 0 C--N 1.331 -0.227 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.311 179.894 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 53' ' ' PRO . . . . . 0.575 ' HD2' ' HB3' ' A' ' 52' ' ' LYS . 97.8 Cg_exo -45.14 -45.72 14.3 Favored 'Trans proline' 0 C--N 1.349 0.587 0 C-N-CA 122.353 2.036 . . . . 0.0 112.484 -179.833 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' TYR . . . . . 0.476 ' CE2' ' HB2' ' A' ' 52' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.468 0.429 0 CA-C-O 121.065 0.459 . . . . 0.0 110.63 179.705 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 11.5 t . . . . . 0 C--O 1.232 0.164 0 N-CA-C 110.313 -0.254 . . . . 0.0 110.313 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 31.8 p -45.94 123.57 4.63 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 120.989 0.423 . . . . 0.0 111.381 -179.497 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.561 ' HB3' ' O ' ' A' ' 23' ' ' CYS . 0.1 OUTLIER -131.25 44.55 2.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.423 -179.707 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.409 ' N ' ' O ' ' A' ' 22' ' ' LEU . 8.8 p -80.81 132.2 35.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.355 -179.41 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.588 HG22 ' N ' ' A' ' 63' ' ' ASP . 1.2 m 177.21 -74.4 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.159 179.811 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ASP . . . . . 0.588 ' N ' HG22 ' A' ' 62' ' ' THR . 67.9 t0 179.99 -37.76 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.595 179.846 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.508 ' HA ' ' CD2' ' A' ' 4' ' ' HIS . 1.5 mtpt -131.1 79.09 1.87 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.607 179.83 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' CYS . . . . . 0.461 ' HB3' ' HB3' ' A' ' 60' ' ' CYS . 0.0 OUTLIER -137.98 7.0 2.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.875 -179.718 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.506 ' HB2' ' HD2' ' A' ' 67' ' ' PRO . 0.1 OUTLIER -57.61 166.63 1.68 Allowed Pre-proline 0 N--CA 1.462 0.162 0 CA-C-O 120.493 0.187 . . . . 0.0 110.695 -179.991 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 67' ' ' PRO . . . . . 0.506 ' HD2' ' HB2' ' A' ' 66' ' ' ASN . 88.6 Cg_exo -44.72 162.96 0.07 OUTLIER 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.409 2.073 . . . . 0.0 112.161 179.688 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -176.24 64.05 0.22 Allowed Pre-proline 0 C--N 1.326 -0.427 0 CA-C-O 120.894 0.378 . . . . 0.0 111.068 -179.605 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -49.57 129.59 23.75 Favored 'Trans proline' 0 C--N 1.344 0.31 0 C-N-CA 122.594 2.196 . . . . 0.0 111.751 179.556 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.503 ' O ' ' C ' ' A' ' 71' ' ' GLN . 0.4 OUTLIER -69.94 -47.25 63.12 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 120.836 -0.346 . . . . 0.0 111.564 -179.231 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.503 ' C ' ' O ' ' A' ' 70' ' ' LYS . 2.2 tt0 . . . . . 0 N--CA 1.471 0.616 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 179.743 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 192' ' ' CYS . . . . . 0.685 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.1 OUTLIER . . . . . 0 CA--C 1.499 -0.993 0 CA-C-O 122.252 1.025 . . . . 0.0 111.972 . . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 193' ' ' CYS . . . . . 0.685 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.1 OUTLIER 36.27 92.71 0.05 OUTLIER Pre-proline 0 C--N 1.314 -0.955 0 CA-C-N 112.795 -2.002 . . . . 0.0 113.119 173.394 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 194' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -59.27 145.03 99.1 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.592 2.195 . . . . 0.0 112.042 179.549 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 78.6 m-20 -131.35 12.17 5.0 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.515 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 196' ' ' THR . . . . . 0.59 ' N ' ' CD ' ' B' ' 197' ' ' PRO . 0.2 OUTLIER -122.26 35.4 0.26 Allowed Pre-proline 0 C--N 1.33 -0.27 0 N-CA-C 112.096 0.406 . . . . 0.0 112.096 179.873 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 197' ' ' PRO . . . . . 0.59 ' CD ' ' N ' ' B' ' 196' ' ' THR . 77.9 Cg_endo -74.73 15.7 0.68 Allowed 'Trans proline' 0 C--N 1.35 0.638 0 C-N-CA 121.551 1.501 . . . . 0.0 108.967 176.203 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 198' ' ' TYR . . . . . 0.589 ' H ' ' C ' ' B' ' 196' ' ' THR . 7.9 t80 . . . . . 0 C--O 1.249 1.028 0 CA-C-N 114.033 -1.44 . . . . 0.0 111.25 -178.741 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 1' ' ' ILE . . . . . 0.574 HG23 ' O ' ' A' ' 62' ' ' THR . 5.1 mp . . . . . 0 N--CA 1.485 1.322 0 CA-C-O 120.421 0.153 . . . . 0.0 111.13 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 2' ' ' VAL . . . . . 0.481 HG22 ' O ' ' A' ' 1' ' ' ILE . 33.3 m 45.82 -179.34 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.312 0 CA-C-O 120.897 0.379 . . . . 0.0 111.865 -179.788 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 55.9 m -128.78 -139.76 0.24 Allowed 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.999 -179.165 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -109.48 -95.77 0.4 Allowed 'General case' 0 CA--C 1.53 0.188 0 O-C-N 122.406 -0.184 . . . . 0.0 110.53 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.3 t -145.13 145.66 31.48 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.974 0.416 . . . . 0.0 110.916 179.396 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.839 HG21 ' HA2' ' A' ' 43' ' ' GLY . 9.6 p -103.19 77.92 1.58 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.892 -179.81 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.498 ' O ' HG23 ' A' ' 8' ' ' THR . . . -177.96 -68.67 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.174 -179.875 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.498 HG23 ' O ' ' A' ' 7' ' ' ALA . 0.6 OUTLIER . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.797 -179.817 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.488 ' N ' ' HD2' ' A' ' 18' ' ' PRO . 35.6 Cg_exo . . . . . 0 CA--C 1.531 0.37 0 N-CA-C 113.42 0.508 . . . . 0.0 113.42 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.488 ' HD2' ' N ' ' A' ' 17' ' ' PRO . 37.3 Cg_exo -38.2 -44.08 1.88 Allowed 'Trans proline' 0 C--N 1.349 0.593 0 C-N-CA 122.918 2.412 . . . . 0.0 113.401 -179.259 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -107.93 -136.22 7.89 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.476 -0.868 . . . . 0.0 113.143 -179.692 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.562 ' CB ' ' HA ' ' A' ' 46' ' ' ALA . 0.3 OUTLIER -35.71 -42.94 0.27 Allowed 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 112.937 0.717 . . . . 0.0 112.937 -179.347 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ASN . . . . . 0.416 ' N ' ' HG2' ' A' ' 20' ' ' GLU . 0.1 OUTLIER 79.19 -52.52 0.44 Allowed 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 114.845 -1.07 . . . . 0.0 110.926 -179.398 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.783 ' O ' ' HA ' ' A' ' 44' ' ' CYS . 0.4 OUTLIER -59.72 118.25 5.93 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 179.368 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.565 ' HA ' ' HA ' ' A' ' 44' ' ' CYS . 6.0 m -80.44 39.7 0.47 Allowed 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 113.091 0.775 . . . . 0.0 113.091 -178.514 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.541 ' CG ' ' HB2' ' A' ' 45' ' ' ALA . 0.1 OUTLIER 43.67 -165.58 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.375 0 CA-C-O 120.71 0.29 . . . . 0.0 111.204 179.55 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.543 ' CB ' HG23 ' A' ' 58' ' ' THR . 0.1 OUTLIER -179.97 90.2 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.979 -0.288 . . . . 0.0 111.615 179.717 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 4.8 mtmt -84.09 110.82 18.78 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.796 179.538 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 1.6 ttp -131.03 92.2 3.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.312 -179.803 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' TRP . . . . . 0.414 ' CE3' ' HA ' ' A' ' 28' ' ' TRP . 0.0 OUTLIER -67.12 -159.81 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.409 179.574 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 93.5 m -148.94 157.54 43.5 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.852 0.358 . . . . 0.0 110.986 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -137.71 121.02 16.97 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.676 179.905 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.427 ' C ' ' CG ' ' A' ' 32' ' ' PHE . . . 62.22 90.39 0.07 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.814 -179.717 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.427 ' CG ' ' C ' ' A' ' 31' ' ' ALA . 4.6 p90 44.48 30.11 0.46 Allowed 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.361 -179.79 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 9.2 t 43.55 55.75 4.78 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.37 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -156.74 28.38 0.32 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.657 179.803 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.429 ' O ' ' C ' ' A' ' 36' ' ' ARG . 43.2 m -138.24 37.86 2.3 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.585 -179.891 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.446 ' HG3' ' HB2' ' A' ' 70' ' ' LYS . 0.2 OUTLIER 25.84 89.77 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 115.739 -0.664 . . . . 0.0 112.275 179.55 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.44 ' N ' ' HG3' ' A' ' 70' ' ' LYS . . . -80.06 -127.33 0.66 Allowed Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.639 -0.791 . . . . 0.0 113.315 -179.557 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.338 0 CA-C-O 120.947 0.404 . . . . 0.0 110.211 -179.302 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' GLY . . . . . 0.839 ' HA2' HG21 ' A' ' 6' ' ' THR . . . . . . . . 0 CA--C 1.515 0.089 0 N-CA-C 113.678 0.231 . . . . 0.0 113.678 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.783 ' HA ' ' O ' ' A' ' 22' ' ' LEU . 59.2 m 61.99 141.26 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.887 0.344 . . . . 0.0 111.348 179.191 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.541 ' HB2' ' CG ' ' A' ' 24' ' ' TYR . . . -130.0 -99.57 0.33 Allowed 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 112.042 0.386 . . . . 0.0 112.042 -179.557 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.562 ' HA ' ' CB ' ' A' ' 20' ' ' GLU . . . -179.33 -41.4 0.01 OUTLIER 'General case' 0 C--O 1.23 0.057 0 CA-C-O 120.906 0.384 . . . . 0.0 110.958 -179.368 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 4.7 t -178.12 45.65 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.118 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.462 ' N ' ' HD3' ' A' ' 49' ' ' PRO . 10.1 m 55.68 62.9 6.78 Favored Pre-proline 0 C--N 1.332 -0.195 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.374 179.733 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.462 ' HD3' ' N ' ' A' ' 48' ' ' CYS . 5.4 Cg_exo -76.47 3.9 5.96 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.755 2.303 . . . . 0.0 111.502 178.862 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.478 ' O ' ' HB2' ' A' ' 51' ' ' LYS . 30.3 t -51.05 -62.55 1.55 Allowed 'General case' 0 N--CA 1.455 -0.195 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.519 -179.804 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.478 ' HB2' ' O ' ' A' ' 50' ' ' SER . 9.5 mtpt 77.87 -50.28 0.5 Allowed 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.483 -179.729 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.36 133.16 20.72 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.003 -179.739 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' PRO . . . . . 0.401 ' HG2' ' CE1' ' A' ' 54' ' ' TYR . 69.2 Cg_endo -76.16 -47.94 0.15 Allowed 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.534 2.156 . . . . 0.0 112.612 -179.855 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' TYR . . . . . 0.404 ' O ' ' CZ3' ' A' ' 28' ' ' TRP . 0.0 OUTLIER . . . . . 0 N--CA 1.47 0.536 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.101 -179.911 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.543 HG23 ' CB ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER . . . . . 0 CA--C 1.534 0.339 0 CA-C-O 120.217 0.056 . . . . 0.0 110.992 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -151.11 160.15 44.06 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 120.94 0.4 . . . . 0.0 111.315 -179.699 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.501 ' HB2' ' O ' ' A' ' 24' ' ' TYR . 0.1 OUTLIER -138.7 -18.59 1.07 Allowed 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.609 179.846 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.657 ' O ' HG23 ' A' ' 62' ' ' THR . 83.1 p -42.8 106.33 0.06 Allowed 'General case' 0 N--CA 1.462 0.17 0 CA-C-O 120.843 0.354 . . . . 0.0 111.859 -179.503 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.657 HG23 ' O ' ' A' ' 61' ' ' SER . 4.0 p -164.84 -76.45 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.601 179.646 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 30.6 p-10 177.58 -39.31 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.704 179.821 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -160.81 56.52 0.31 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.998 -0.547 . . . . 0.0 110.486 179.712 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' CYS . . . . . 0.426 ' O ' ' C ' ' A' ' 66' ' ' ASN . 1.3 p -55.12 -62.73 1.47 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.366 -179.499 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.426 ' C ' ' O ' ' A' ' 65' ' ' CYS . 1.3 p-10 29.69 62.02 0.86 Allowed Pre-proline 0 N--CA 1.468 0.466 0 C-N-CA 122.625 0.37 . . . . 0.0 111.962 -179.78 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' PRO . . . . . 0.417 ' HG2' ' HG2' ' A' ' 25' ' ' ARG . 54.0 Cg_exo -52.35 -57.21 2.24 Favored 'Trans proline' 0 C--N 1.343 0.274 0 C-N-CA 122.651 2.234 . . . . 0.0 112.8 -179.631 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.468 ' HB3' ' HD2' ' A' ' 69' ' ' PRO . 15.7 m170 62.34 161.01 0.12 Allowed Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.349 -179.671 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' PRO . . . . . 0.468 ' HD2' ' HB3' ' A' ' 68' ' ' HIS . 67.7 Cg_exo -36.23 126.07 0.37 Allowed 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 123.046 2.497 . . . . 0.0 112.791 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.446 ' HB2' ' HG3' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -57.44 -16.9 10.68 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.288 -179.977 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.332 -0.179 0 CA-C-O 120.969 0.414 . . . . 0.0 110.736 179.652 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 192' ' ' CYS . . . . . 0.7 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.5 OUTLIER . . . . . 0 CA--C 1.501 -0.939 0 CA-C-O 121.965 0.888 . . . . 0.0 112.296 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 193' ' ' CYS . . . . . 0.7 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.0 OUTLIER -150.28 107.73 3.17 Favored Pre-proline 0 N--CA 1.434 -1.227 0 CA-C-N 113.492 -1.685 . . . . 0.0 111.903 -173.736 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 194' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -76.36 178.47 7.49 Favored 'Trans proline' 0 C--N 1.348 0.522 0 C-N-CA 122.545 2.163 . . . . 0.0 112.054 179.735 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 195' ' ' ASP . . . . . 0.414 ' C ' ' HD3' ' B' ' 197' ' ' PRO . 4.8 t0 55.06 100.18 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.916 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 196' ' ' THR . . . . . 0.754 ' N ' ' HD3' ' B' ' 197' ' ' PRO . 1.8 t -112.08 20.57 0.07 OUTLIER Pre-proline 0 CA--C 1.533 0.293 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 -179.783 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 197' ' ' PRO . . . . . 0.754 ' HD3' ' N ' ' B' ' 196' ' ' THR . 6.6 Cg_exo -68.52 19.43 0.14 Allowed 'Trans proline' 0 C--N 1.358 1.068 0 CA-C-N 120.382 1.172 . . . . 0.0 109.6 176.302 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 198' ' ' TYR . . . . . 0.679 ' H ' ' C ' ' B' ' 196' ' ' THR . 64.9 t80 . . . . . 0 C--O 1.249 1.046 0 CA-C-N 114.535 -1.211 . . . . 0.0 111.248 -178.828 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 1' ' ' ILE . . . . . 0.837 HG22 ' HB2' ' A' ' 63' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.445 0 CA-C-O 120.827 0.346 . . . . 0.0 110.989 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 2' ' ' VAL . . . . . 0.45 ' O ' ' HB3' ' A' ' 63' ' ' ASP . 48.9 t -125.7 133.27 69.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.796 179.629 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.517 ' O ' ' C ' ' A' ' 4' ' ' HIS . 19.4 m -92.33 65.22 4.53 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -178.545 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 4' ' ' HIS . . . . . 0.517 ' C ' ' O ' ' A' ' 3' ' ' CYS . 1.8 m-70 -10.49 93.03 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 112.651 0.611 . . . . 0.0 112.651 179.596 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.422 ' O ' ' O ' ' A' ' 4' ' ' HIS . 0.0 OUTLIER 39.24 -166.07 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 115.951 -0.568 . . . . 0.0 112.042 179.492 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.601 ' O ' ' HB3' ' A' ' 7' ' ' ALA . 3.9 t -99.25 23.31 9.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.712 179.836 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.601 ' HB3' ' O ' ' A' ' 6' ' ' THR . . . 86.87 -31.3 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.624 -179.847 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.476 ' OG1' HG23 ' A' ' 6' ' ' THR . 0.2 OUTLIER . . . . . 0 C--N 1.33 -0.243 0 CA-C-O 120.673 0.273 . . . . 0.0 111.149 -179.824 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.67 ' HB2' HD12 ' A' ' 1' ' ' ILE . 9.2 Cg_endo . . . . . 0 CA--C 1.527 0.146 0 N-CA-C 112.861 0.293 . . . . 0.0 112.861 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.404 ' CD ' ' HB2' ' A' ' 21' ' ' ASN . 1.9 Cg_endo -82.16 -57.83 0.03 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.55 0 C-N-CA 122.993 2.462 . . . . 0.0 111.451 179.494 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -124.98 -40.81 0.4 Allowed Glycine 0 N--CA 1.45 -0.421 0 CA-C-N 115.836 -0.62 . . . . 0.0 112.009 179.559 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 24.9 tp10 -160.11 68.33 0.38 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.897 0.38 . . . . 0.0 110.83 179.86 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ASN . . . . . 0.404 ' HB2' ' CD ' ' A' ' 18' ' ' PRO . 2.9 m-80 -140.95 83.51 1.89 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.045 -179.856 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.833 HD13 ' CB ' ' A' ' 61' ' ' SER . 47.2 mt -52.29 151.54 3.9 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.814 0.34 . . . . 0.0 111.11 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.584 ' HA ' ' HA ' ' A' ' 44' ' ' CYS . 5.3 t -78.66 167.91 20.53 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.6 179.845 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.64 ' CE1' ' HB2' ' A' ' 45' ' ' ALA . 0.2 OUTLIER -121.49 -176.31 3.27 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-O 120.737 0.303 . . . . 0.0 110.902 179.851 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 4.5 ttm180 -176.28 97.76 0.06 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.254 179.889 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 2.7 mtpt -80.65 148.23 30.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.298 179.487 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -154.17 98.61 2.16 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.835 0.35 . . . . 0.0 111.605 -179.796 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 1.8 t90 -77.86 -144.68 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.32 179.409 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 38.5 t -176.71 -36.4 0.01 OUTLIER 'General case' 0 C--O 1.231 0.083 0 CA-C-O 120.744 0.307 . . . . 0.0 111.11 -179.814 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 1.6 t70 77.84 -61.46 0.4 Allowed 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.906 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -174.24 96.17 0.09 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.884 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER 58.88 104.62 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.405 -179.627 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -112.41 -83.56 0.59 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.277 -179.645 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 4.1 p 70.09 -60.22 0.49 Allowed 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.765 0.317 . . . . 0.0 110.639 -179.574 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -110.51 -21.77 11.99 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.964 179.794 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.59 -86.19 0.03 OUTLIER 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 116.627 -0.261 . . . . 0.0 110.945 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.403 ' O ' ' C ' ' A' ' 38' ' ' LYS . . . 73.84 -88.48 0.65 Allowed Glycine 0 C--N 1.334 0.455 0 C-N-CA 120.467 -0.873 . . . . 0.0 112.741 179.896 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.462 ' HB3' ' HB2' ' A' ' 70' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.467 0.382 0 CA-C-O 121.065 0.46 . . . . 0.0 111.872 -179.826 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.325 0 CA-C-O 120.083 -0.287 . . . . 0.0 113.376 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.584 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 0.5 OUTLIER 61.44 131.83 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.169 0.509 . . . . 0.0 111.847 179.345 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.64 ' HB2' ' CE1' ' A' ' 24' ' ' TYR . . . -104.29 -171.83 2.0 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.895 179.861 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -120.54 -16.24 8.35 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 112.117 0.414 . . . . 0.0 112.117 -179.716 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 5.1 t -160.76 26.51 0.15 Allowed 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 111.902 0.334 . . . . 0.0 111.902 -179.784 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER 51.6 53.6 13.48 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-O 120.686 0.279 . . . . 0.0 111.06 179.583 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -70.41 58.88 1.91 Allowed 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.285 1.99 . . . . 0.0 110.338 178.606 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 36.3 t -130.12 133.3 46.55 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.474 -0.784 . . . . 0.0 111.024 -178.364 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 175.22 46.08 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.799 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.405 ' HB2' ' HD2' ' A' ' 53' ' ' PRO . 0.6 OUTLIER -127.96 164.17 38.73 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.707 -179.963 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 53' ' ' PRO . . . . . 0.405 ' HD2' ' HB2' ' A' ' 52' ' ' LYS . 11.2 Cg_endo -54.91 -162.97 0.01 OUTLIER 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.725 2.283 . . . . 0.0 112.268 -180.0 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.472 0.645 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.378 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 11.6 t . . . . . 0 CA--C 1.528 0.106 0 CA-C-O 120.801 0.334 . . . . 0.0 110.906 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 10.8 m 60.02 110.92 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.179 179.858 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.498 ' HB3' ' C ' ' A' ' 23' ' ' CYS . 46.9 t -100.29 35.27 2.13 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.422 179.599 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.833 ' CB ' HD13 ' A' ' 22' ' ' LEU . 52.9 p -60.79 80.25 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.117 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.73 -180.0 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.67 HG22 ' HG2' ' A' ' 64' ' ' LYS . 55.0 m 179.47 -33.24 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.364 -0.835 . . . . 0.0 109.384 -179.77 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ASP . . . . . 0.837 ' HB2' HG22 ' A' ' 1' ' ' ILE . 0.8 OUTLIER 70.63 60.91 0.2 Allowed 'General case' 0 C--O 1.23 0.077 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.724 179.548 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.67 ' HG2' HG22 ' A' ' 62' ' ' THR . 5.5 ptmm? 178.82 39.71 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.647 179.267 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 2.3 m -103.01 17.71 23.41 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.04 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 6.6 p-10 -137.55 87.1 17.94 Favored Pre-proline 0 C--N 1.332 -0.186 0 CA-C-O 120.727 0.299 . . . . 0.0 111.481 -179.715 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -79.61 -42.32 0.17 Allowed 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.687 2.258 . . . . 0.0 112.041 179.71 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.419 ' HB3' ' HD2' ' A' ' 69' ' ' PRO . 53.6 m80 -133.28 162.03 60.17 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.534 179.863 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' PRO . . . . . 0.419 ' HD2' ' HB3' ' A' ' 68' ' ' HIS . 75.7 Cg_exo -49.39 -63.75 0.27 Allowed 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.414 2.076 . . . . 0.0 112.615 -179.859 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.462 ' HB2' ' HB3' ' A' ' 38' ' ' LYS . 0.0 OUTLIER -88.57 -159.19 0.53 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.834 -179.809 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 39.9 tt0 . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.803 179.918 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 192' ' ' CYS . . . . . 0.719 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.0 OUTLIER . . . . . 0 CA--C 1.5 -0.962 0 CA-C-O 122.015 0.912 . . . . 0.0 112.198 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 193' ' ' CYS . . . . . 0.719 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.0 OUTLIER 47.18 82.45 0.23 Allowed Pre-proline 0 N--CA 1.438 -1.037 0 CA-C-N 113.466 -1.697 . . . . 0.0 111.945 173.799 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 194' ' ' PRO . . . . . 0.408 ' HA ' ' O ' ' A' ' 8' ' ' THR . 50.0 Cg_exo -53.81 172.55 0.25 Allowed 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.677 2.251 . . . . 0.0 112.482 -179.899 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 195' ' ' ASP . . . . . 0.427 ' HB2' ' CD ' ' B' ' 197' ' ' PRO . 8.5 m-20 -71.6 -161.83 0.07 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.815 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 196' ' ' THR . . . . . 0.766 ' C ' ' H ' ' B' ' 198' ' ' TYR . 41.5 p -89.83 -5.17 0.1 Allowed Pre-proline 0 CA--C 1.532 0.256 0 N-CA-C 113.793 1.034 . . . . 0.0 113.793 -179.337 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 197' ' ' PRO . . . . . 0.669 ' CD ' ' N ' ' B' ' 196' ' ' THR . 22.8 Cg_exo -62.29 20.98 0.05 OUTLIER 'Trans proline' 0 C--N 1.357 1.014 0 CA-C-N 120.944 1.373 . . . . 0.0 110.282 177.327 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 198' ' ' TYR . . . . . 0.766 ' H ' ' C ' ' B' ' 196' ' ' THR . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.056 0 CA-C-N 114.713 -1.13 . . . . 0.0 110.931 -179.342 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 1' ' ' ILE . . . . . 0.463 HG23 ' HA ' ' A' ' 62' ' ' THR . 1.7 mp . . . . . 0 N--CA 1.486 1.341 0 CA-C-O 120.953 0.406 . . . . 0.0 111.139 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 2' ' ' VAL . . . . . 0.467 HG13 ' N ' ' A' ' 3' ' ' CYS . 0.3 OUTLIER -160.87 178.15 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.191 -179.914 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.467 ' N ' HG13 ' A' ' 2' ' ' VAL . 4.6 m -67.82 -159.7 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.252 179.79 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 4' ' ' HIS . . . . . 0.457 ' CE1' ' ND2' ' A' ' 66' ' ' ASN . 0.0 OUTLIER -156.84 142.05 17.28 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-O 121.263 0.554 . . . . 0.0 112.122 179.978 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 13.4 p -53.98 -31.03 49.48 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.428 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.56 -6.55 1.14 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.61 179.188 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.4 ' O ' ' HB ' ' A' ' 8' ' ' THR . . . -73.0 132.62 43.63 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.199 179.945 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.4 ' HB ' ' O ' ' A' ' 7' ' ' ALA . 89.4 m . . . . . 0 C--N 1.331 -0.206 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.077 179.862 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.48 ' HB2' ' HD3' ' A' ' 18' ' ' PRO . 38.6 Cg_exo . . . . . 0 CA--C 1.53 0.276 0 N-CA-C 112.83 0.281 . . . . 0.0 112.83 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.48 ' HD3' ' HB2' ' A' ' 17' ' ' PRO . 89.3 Cg_endo -81.46 -171.82 1.32 Allowed 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.499 2.133 . . . . 0.0 112.412 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -112.73 144.5 17.97 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.175 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 58.14 72.25 0.53 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.921 0.391 . . . . 0.0 110.65 -179.814 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -119.86 -7.34 10.0 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.647 -179.353 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.978 HD12 ' CB ' ' A' ' 48' ' ' CYS . 1.5 mt 61.88 88.33 0.09 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.53 0.205 . . . . 0.0 110.838 179.773 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.446 ' HA ' ' CA ' ' A' ' 44' ' ' CYS . 1.7 t -59.5 73.94 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.494 -179.794 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.471 ' CB ' ' HA ' ' A' ' 59' ' ' CYS . 0.0 OUTLIER -114.97 156.59 24.78 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.843 -179.069 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 2.8 ttt180 -144.7 -81.09 0.17 Allowed 'General case' 0 CA--C 1.53 0.208 0 CA-C-O 120.836 0.35 . . . . 0.0 111.559 179.146 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 2.8 mtmm -179.77 110.52 0.04 OUTLIER 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.318 -179.725 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -89.19 122.54 32.58 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.843 -179.586 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -87.58 -179.86 6.4 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.856 0.36 . . . . 0.0 110.986 179.966 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 8.4 m -158.93 -178.04 6.95 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.798 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -109.24 -75.75 0.62 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.842 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -127.37 -70.07 0.72 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.975 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 37.6 t80 -102.27 -29.34 11.74 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.848 179.821 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 62.23 85.62 0.12 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.786 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 11.4 p -98.97 -57.57 2.14 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.976 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 2.3 p -135.11 31.69 3.22 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.991 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 2.8 mtt85 -107.84 -81.41 0.56 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.872 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 49.83 39.37 32.06 Favored Glycine 0 C--N 1.331 0.271 0 C-N-CA 120.818 -0.706 . . . . 0.0 112.775 179.894 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.572 ' HA ' ' HG2' ' A' ' 70' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.306 0 CA-C-O 120.712 0.291 . . . . 0.0 111.068 -179.814 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' GLY . . . . . 0.432 ' N ' ' O ' ' A' ' 24' ' ' TYR . . . . . . . . 0 N--CA 1.45 -0.387 0 N-CA-C 112.509 -0.236 . . . . 0.0 112.509 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.483 ' HA ' ' O ' ' A' ' 22' ' ' LEU . 0.7 OUTLIER 59.25 129.86 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.197 0 N-CA-C 113.362 0.875 . . . . 0.0 113.362 178.528 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.416 ' O ' ' N ' ' A' ' 47' ' ' THR . . . -152.92 113.27 4.02 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.091 -0.959 . . . . 0.0 110.237 178.76 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.503 ' C ' HG22 ' A' ' 47' ' ' THR . . . -60.75 78.61 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.97 -179.316 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.676 HG23 ' H ' ' A' ' 48' ' ' CYS . 0.0 OUTLIER 167.71 -77.61 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.688 179.331 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.978 ' CB ' HD12 ' A' ' 22' ' ' LEU . 0.0 OUTLIER 47.41 63.1 10.75 Favored Pre-proline 0 C--O 1.233 0.209 0 CA-C-O 120.991 0.424 . . . . 0.0 111.944 179.353 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.443 ' HD3' ' N ' ' A' ' 48' ' ' CYS . 74.2 Cg_endo -94.84 11.45 1.62 Allowed 'Trans proline' 0 N--CA 1.451 -1.029 0 C-N-CA 123.371 2.714 . . . . 0.0 110.99 178.62 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 46.2 t -61.89 142.11 57.59 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 115.289 -0.869 . . . . 0.0 111.731 -179.241 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 6.9 mttm -164.94 54.1 0.12 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.178 179.718 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.469 ' CB ' ' HD2' ' A' ' 53' ' ' PRO . 0.0 OUTLIER -112.73 168.37 7.79 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.931 -179.525 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 53' ' ' PRO . . . . . 0.469 ' HD2' ' CB ' ' A' ' 52' ' ' LYS . 12.5 Cg_endo -55.81 -162.05 0.01 OUTLIER 'Trans proline' 0 C--N 1.348 0.536 0 C-N-CA 122.778 2.318 . . . . 0.0 112.375 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.47 0.541 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.177 -179.871 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.411 ' O ' ' HB2' ' A' ' 59' ' ' CYS . 60.1 p . . . . . 0 CA--C 1.53 0.175 0 CA-C-O 120.845 0.355 . . . . 0.0 110.498 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' CYS . . . . . 0.471 ' HA ' ' CB ' ' A' ' 24' ' ' TYR . 5.4 m 69.19 103.94 0.06 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.864 179.767 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.453 ' O ' ' HB3' ' A' ' 22' ' ' LEU . 0.0 OUTLIER -74.37 -160.39 0.1 Allowed 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.703 179.831 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.706 ' HB2' HD22 ' A' ' 22' ' ' LEU . 0.0 OUTLIER 167.72 137.69 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 120.958 0.409 . . . . 0.0 111.623 179.518 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.463 ' HA ' HG23 ' A' ' 1' ' ' ILE . 0.0 OUTLIER 35.09 -91.66 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 115.474 -0.784 . . . . 0.0 112.158 179.318 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ASP . . . . . 0.41 ' O ' ' N ' ' A' ' 65' ' ' CYS . 9.3 p-10 -55.82 125.64 22.19 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.84 0.353 . . . . 0.0 111.257 -179.689 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 3.3 pttp -56.32 86.98 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.654 179.796 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' CYS . . . . . 0.41 ' N ' ' O ' ' A' ' 63' ' ' ASP . 0.1 OUTLIER -77.24 58.69 1.66 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.297 -179.641 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.566 ' N ' ' HD3' ' A' ' 67' ' ' PRO . 1.0 OUTLIER -167.06 55.87 0.34 Allowed Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.756 179.24 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 67' ' ' PRO . . . . . 0.566 ' HD3' ' N ' ' A' ' 66' ' ' ASN . 26.2 Cg_exo -62.03 -65.67 0.06 OUTLIER 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 122.516 2.144 . . . . 0.0 112.41 -179.782 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -110.85 158.32 36.06 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.757 -179.838 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 7.9 Cg_exo -71.09 -74.63 0.01 OUTLIER 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.643 2.229 . . . . 0.0 112.314 -179.691 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.577 ' HD2' ' N ' ' A' ' 70' ' ' LYS . 0.0 OUTLIER 177.41 -102.16 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 116.686 -0.234 . . . . 0.0 111.396 -179.969 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 37.3 tp60 . . . . . 0 C--O 1.231 0.086 0 CA-C-O 120.713 0.292 . . . . 0.0 111.216 -179.572 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 192' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.504 -0.811 0 CA-C-O 122.03 0.919 . . . . 0.0 112.347 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 193' ' ' CYS . . . . . 0.487 ' N ' ' HD3' ' B' ' 194' ' ' PRO . 0.6 OUTLIER 31.24 58.42 1.07 Allowed Pre-proline 0 N--CA 1.438 -1.049 0 CA-C-N 112.782 -2.008 . . . . 0.0 113.209 172.609 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 194' ' ' PRO . . . . . 0.487 ' HD3' ' N ' ' B' ' 193' ' ' CYS . 57.1 Cg_endo -90.53 -68.31 0.01 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.801 0 C-N-CA 122.779 2.319 . . . . 0.0 112.502 179.9 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 178.94 129.77 0.07 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.84 0.352 . . . . 0.0 110.801 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 196' ' ' THR . . . . . 0.676 ' N ' ' HD3' ' B' ' 197' ' ' PRO . 11.4 t -139.4 46.2 1.04 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.95 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 197' ' ' PRO . . . . . 0.676 ' HD3' ' N ' ' B' ' 196' ' ' THR . 5.7 Cg_exo -73.54 12.62 0.84 Allowed 'Trans proline' 0 C--N 1.35 0.639 0 C-N-CA 121.688 1.592 . . . . 0.0 108.699 175.963 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 198' ' ' TYR . . . . . 0.59 ' H ' ' C ' ' B' ' 196' ' ' THR . 8.2 t80 . . . . . 0 C--O 1.249 1.076 0 CA-C-N 113.963 -1.471 . . . . 0.0 111.273 -178.855 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 1' ' ' ILE . . . . . 0.758 HG23 ' O ' ' A' ' 62' ' ' THR . 29.0 mm . . . . . 0 N--CA 1.486 1.369 0 CA-C-O 120.729 0.299 . . . . 0.0 111.07 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 2' ' ' VAL . . . . . 0.565 HG22 ' H ' ' A' ' 3' ' ' CYS . 3.6 p -172.37 170.69 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.002 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.565 ' H ' HG22 ' A' ' 2' ' ' VAL . 1.4 p -113.3 -162.14 0.79 Allowed 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 116.649 -0.25 . . . . 0.0 111.112 -179.521 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 4' ' ' HIS . . . . . 0.48 ' NE2' ' HB2' ' A' ' 66' ' ' ASN . 1.6 p80 -146.3 -175.96 4.98 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.874 0.369 . . . . 0.0 111.089 -179.851 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -97.9 80.97 2.8 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.69 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.532 HG21 ' O ' ' A' ' 67' ' ' PRO . 96.7 m -89.77 -3.68 58.04 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.826 179.705 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.493 ' HB1' ' NH1' ' A' ' 25' ' ' ARG . . . -79.4 131.66 36.16 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.738 0.304 . . . . 0.0 110.828 179.838 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 5.1 p . . . . . 0 C--N 1.328 -0.332 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.696 -179.647 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.579 ' N ' ' HD2' ' A' ' 18' ' ' PRO . 6.8 Cg_endo . . . . . 0 CA--C 1.535 0.532 0 N-CA-C 113.843 0.67 . . . . 0.0 113.843 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.579 ' HD2' ' N ' ' A' ' 17' ' ' PRO . 12.3 Cg_endo -55.83 -80.34 0.02 OUTLIER 'Trans proline' 0 C--N 1.349 0.582 0 C-N-CA 122.186 1.924 . . . . 0.0 112.733 -179.162 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -151.8 -148.31 4.8 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.49 -0.862 . . . . 0.0 112.65 -179.789 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 58.36 -179.39 0.07 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.798 0.332 . . . . 0.0 110.663 -179.869 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ASN . . . . . 0.609 ' H ' HD12 ' A' ' 22' ' ' LEU . 14.0 p30 -177.25 39.29 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.898 -179.988 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.738 HD22 ' SG ' ' A' ' 48' ' ' CYS . 0.4 OUTLIER -146.72 81.67 1.56 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.758 179.935 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.837 ' HA ' ' H ' ' A' ' 44' ' ' CYS . 6.5 m -58.02 120.66 8.95 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.994 -179.698 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.897 ' CD1' ' HB2' ' A' ' 45' ' ' ALA . 0.4 OUTLIER -133.47 -32.66 1.14 Allowed 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 113.032 0.753 . . . . 0.0 113.032 -178.303 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.493 ' NH1' ' HB1' ' A' ' 7' ' ' ALA . 1.6 ttm180 37.1 -117.55 0.15 Allowed 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 112.677 0.621 . . . . 0.0 112.677 -178.504 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -156.41 126.49 6.48 Favored 'General case' 0 C--N 1.344 0.332 0 C-N-CA 122.351 0.26 . . . . 0.0 110.574 -179.513 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 3.0 tmm? -104.92 159.33 15.89 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.606 0.241 . . . . 0.0 110.881 -179.688 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' TRP . . . . . 0.415 ' O ' ' HA2' ' A' ' 37' ' ' GLY . 3.2 t-105 -130.21 143.71 50.94 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.904 0.383 . . . . 0.0 111.286 179.84 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' CYS . . . . . 0.516 ' HB3' ' N ' ' A' ' 37' ' ' GLY . 0.0 OUTLIER 61.48 131.98 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.853 -179.9 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 3.7 t0 -178.76 -177.94 0.54 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.747 179.887 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . 64.28 -80.8 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.287 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -120.54 56.58 0.98 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.838 0.351 . . . . 0.0 111.033 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 46.4 t -127.04 83.63 2.19 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.909 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 37.2 p -48.59 -43.11 35.73 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-O 120.948 0.404 . . . . 0.0 110.697 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.445 ' O ' ' C ' ' A' ' 36' ' ' ARG . 0.3 OUTLIER -93.27 -151.01 0.29 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.921 179.335 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.475 ' HB3' ' CB ' ' A' ' 29' ' ' CYS . 0.3 OUTLIER 28.6 -139.97 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 122.593 0.357 . . . . 0.0 111.62 179.178 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.516 ' N ' ' HB3' ' A' ' 29' ' ' CYS . . . 65.35 9.23 41.83 Favored Glycine 0 C--N 1.338 0.66 0 C-N-CA 120.041 -1.076 . . . . 0.0 113.17 179.839 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.428 ' HB3' ' HB3' ' A' ' 69' ' ' PRO . 0.0 OUTLIER . . . . . 0 N--CA 1.463 0.204 0 CA-C-N 117.071 0.436 . . . . 0.0 110.991 179.736 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' GLY . . . . . 0.425 ' N ' ' HB2' ' A' ' 25' ' ' ARG . . . . . . . . 0 N--CA 1.449 -0.496 0 N-CA-C 111.387 -0.685 . . . . 0.0 111.387 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.837 ' H ' ' HA ' ' A' ' 23' ' ' CYS . 70.8 m 65.4 140.84 0.02 OUTLIER 'General case' 0 N--CA 1.461 0.115 0 CA-C-O 120.977 0.417 . . . . 0.0 111.685 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.897 ' HB2' ' CD1' ' A' ' 24' ' ' TYR . . . -117.19 -82.47 0.63 Allowed 'General case' 0 C--O 1.232 0.143 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.214 179.779 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.548 ' HB2' ' O ' ' A' ' 45' ' ' ALA . . . 169.22 -39.37 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.897 0.38 . . . . 0.0 110.963 -179.861 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.7 m -162.71 -7.77 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 116.078 -0.51 . . . . 0.0 112.018 -179.417 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.738 ' SG ' HD22 ' A' ' 22' ' ' LEU . 1.5 m 64.22 59.35 1.64 Allowed Pre-proline 0 C--N 1.332 -0.186 0 CA-C-O 120.539 0.209 . . . . 0.0 111.234 179.842 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.51 ' HD3' ' N ' ' A' ' 48' ' ' CYS . 2.9 Cg_endo -79.99 -2.02 11.8 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 122.675 2.25 . . . . 0.0 111.473 178.906 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 34.7 t -53.91 144.78 17.88 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.727 -0.669 . . . . 0.0 111.575 -179.857 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 7.5 pttt 179.99 75.22 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.767 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.42 ' HB2' ' HD2' ' A' ' 53' ' ' PRO . 0.6 OUTLIER -150.49 162.68 26.7 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.837 -179.864 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 53' ' ' PRO . . . . . 0.42 ' HD2' ' HB2' ' A' ' 52' ' ' LYS . 9.8 Cg_endo -50.81 -72.6 0.04 OUTLIER 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.741 2.294 . . . . 0.0 112.257 179.887 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.47 0.564 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.953 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.406 ' OG1' ' N ' ' A' ' 59' ' ' CYS . 0.0 OUTLIER . . . . . 0 CA--C 1.533 0.324 0 N-CA-C 110.562 -0.162 . . . . 0.0 110.562 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' CYS . . . . . 0.481 ' HA ' ' HB3' ' A' ' 24' ' ' TYR . 0.8 OUTLIER 167.45 172.41 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 120.778 0.323 . . . . 0.0 110.648 179.772 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.536 ' HB2' ' O ' ' A' ' 23' ' ' CYS . 9.7 t -125.05 -86.49 0.63 Allowed 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.117 -179.603 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.453 ' O ' HG23 ' A' ' 62' ' ' THR . 19.6 p 53.59 -158.23 0.16 Allowed 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 120.603 0.24 . . . . 0.0 111.223 179.663 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.758 ' O ' HG23 ' A' ' 1' ' ' ILE . 0.1 OUTLIER 46.83 -90.46 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.565 -179.966 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -127.03 -178.74 4.53 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.817 0.342 . . . . 0.0 111.099 -179.795 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.9 ptpp? -68.22 73.53 0.21 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.854 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 18.0 p -57.28 -31.0 65.16 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.263 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.48 ' HB2' ' NE2' ' A' ' 4' ' ' HIS . 1.5 m-80 -31.16 92.82 0.05 OUTLIER Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 115.656 -0.702 . . . . 0.0 112.477 -178.642 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' PRO . . . . . 0.532 ' O ' HG21 ' A' ' 6' ' ' THR . 71.7 Cg_endo -90.04 -170.93 0.44 Allowed 'Trans proline' 0 N--CA 1.457 -0.63 0 C-N-CA 123.029 2.486 . . . . 0.0 112.56 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.474 ' HB3' ' HD2' ' A' ' 69' ' ' PRO . 27.3 m80 -110.52 166.01 11.59 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.366 179.707 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' PRO . . . . . 0.474 ' HD2' ' HB3' ' A' ' 68' ' ' HIS . 83.0 Cg_exo -49.13 133.1 28.99 Favored 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 122.393 2.062 . . . . 0.0 112.013 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -46.73 -41.13 14.66 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.473 -179.463 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.682 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 192' ' ' CYS . . . . . 0.71 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.0 OUTLIER . . . . . 0 CA--C 1.499 -0.993 0 CA-C-O 121.927 0.87 . . . . 0.0 111.756 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 193' ' ' CYS . . . . . 0.71 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.0 OUTLIER 46.51 82.13 0.24 Allowed Pre-proline 0 N--CA 1.44 -0.952 0 CA-C-N 113.598 -1.637 . . . . 0.0 112.043 173.602 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 194' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -83.54 52.5 3.86 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.899 2.399 . . . . 0.0 112.644 -179.763 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -178.5 110.72 0.06 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.883 0.373 . . . . 0.0 111.4 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 196' ' ' THR . . . . . 0.58 ' C ' ' H ' ' B' ' 198' ' ' TYR . 4.9 t -152.75 41.9 0.2 Allowed Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.648 179.698 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 197' ' ' PRO . . . . . 0.519 ' CD ' ' N ' ' B' ' 196' ' ' THR . 74.4 Cg_endo -72.77 11.47 0.85 Allowed 'Trans proline' 0 C--N 1.348 0.526 0 C-N-CA 121.607 1.538 . . . . 0.0 108.951 176.277 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 198' ' ' TYR . . . . . 0.58 ' H ' ' C ' ' B' ' 196' ' ' THR . 0.9 OUTLIER . . . . . 0 C--O 1.248 1.019 0 CA-C-N 113.9 -1.5 . . . . 0.0 111.153 -179.088 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 1' ' ' ILE . . . . . 0.408 HD12 ' N ' ' A' ' 1' ' ' ILE . 4.5 mp . . . . . 0 N--CA 1.486 1.363 0 CA-C-O 120.704 0.288 . . . . 0.0 111.055 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 2' ' ' VAL . . . . . 0.638 HG12 ' H ' ' A' ' 4' ' ' HIS . 53.4 t 62.53 144.47 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.807 -179.925 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 14.5 p -117.48 24.67 10.95 Favored 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 113.34 0.866 . . . . 0.0 113.34 -178.079 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' HIS . . . . . 0.638 ' H ' HG12 ' A' ' 2' ' ' VAL . 0.0 OUTLIER 68.07 162.7 0.2 Allowed 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 118.185 0.448 . . . . 0.0 110.073 -179.757 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.3 p -78.82 -161.96 0.34 Allowed 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 110.361 -0.237 . . . . 0.0 110.361 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 16.9 p -74.98 53.7 0.62 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.769 0.319 . . . . 0.0 111.106 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 48.24 -148.15 0.22 Allowed 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 116.484 -0.326 . . . . 0.0 110.897 179.894 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.446 HG23 ' HD2' ' B' ' 194' ' ' PRO . 0.2 OUTLIER . . . . . 0 N--CA 1.461 0.099 0 CA-C-O 121.14 0.495 . . . . 0.0 111.324 179.585 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo . . . . . 0 C--O 1.231 0.152 0 N-CA-C 112.725 0.241 . . . . 0.0 112.725 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_exo -69.66 -52.81 0.31 Allowed 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.557 2.171 . . . . 0.0 111.399 179.376 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -112.82 -34.5 1.85 Allowed Glycine 0 N--CA 1.45 -0.377 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.999 179.54 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.445 ' HB2' HD12 ' A' ' 22' ' ' LEU . 0.0 OUTLIER -73.12 -175.6 1.88 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.786 0.327 . . . . 0.0 110.792 179.941 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 21.3 m-20 -123.78 -0.4 8.54 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.647 -179.885 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.591 HD22 ' HB2' ' A' ' 59' ' ' CYS . 0.1 OUTLIER -103.81 177.13 4.93 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.773 0.321 . . . . 0.0 110.917 -179.94 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.494 ' HA ' ' HA ' ' A' ' 44' ' ' CYS . 35.6 t -157.88 8.33 0.15 Allowed 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 -179.384 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.631 ' CE1' ' HB3' ' A' ' 45' ' ' ALA . 3.2 m-85 52.18 173.09 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 120.643 0.258 . . . . 0.0 111.001 -179.723 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.477 ' HB2' ' O ' ' A' ' 24' ' ' TYR . 0.6 OUTLIER 161.35 104.28 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.907 179.675 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.0 -179.65 0.05 Allowed 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 178.932 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' MET . . . . . 0.474 ' O ' ' O ' ' A' ' 28' ' ' TRP . 0.0 OUTLIER -146.04 44.75 1.25 Allowed 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.114 -0.635 . . . . 0.0 112.405 -179.522 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 28' ' ' TRP . . . . . 0.63 ' HB2' ' HA2' ' A' ' 37' ' ' GLY . 14.3 p-90 45.65 172.3 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 113.482 0.919 . . . . 0.0 113.482 178.28 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' CYS . . . . . 0.402 ' HB2' ' HE3' ' A' ' 28' ' ' TRP . 0.5 OUTLIER 37.1 -157.72 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 114.855 -1.066 . . . . 0.0 111.996 179.735 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 19.7 t0 -165.95 92.95 0.52 Allowed 'General case' 0 C--N 1.334 -0.096 0 CA-C-O 120.943 0.402 . . . . 0.0 111.206 -179.874 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . 62.79 140.13 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.709 179.578 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 17.6 t80 45.8 84.07 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 115.934 -0.576 . . . . 0.0 111.488 179.751 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 85.4 m -153.19 133.0 13.17 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.092 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -126.06 -44.21 1.77 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.752 179.888 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 1.2 m -93.13 -51.76 4.88 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.815 179.877 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 5.1 mpt_? -57.65 -170.15 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.728 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.63 ' HA2' ' HB2' ' A' ' 28' ' ' TRP . . . 105.07 -133.95 11.81 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.554 -0.831 . . . . 0.0 113.146 179.666 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.51 ' HD3' ' N ' ' A' ' 38' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.334 -0.085 0 CA-C-O 121.054 0.454 . . . . 0.0 110.914 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' GLY . . . . . 0.454 ' CA ' ' HB2' ' A' ' 24' ' ' TYR . . . . . . . . 0 CA--C 1.518 0.233 0 N-CA-C 112.827 -0.109 . . . . 0.0 112.827 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.494 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 0.9 OUTLIER 66.88 90.18 0.1 Allowed 'General case' 0 C--O 1.232 0.139 0 CA-C-O 121.034 0.445 . . . . 0.0 110.862 -179.783 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.631 ' HB3' ' CE1' ' A' ' 24' ' ' TYR . . . -128.08 -165.04 1.44 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.897 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -141.51 55.52 1.52 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.953 0.406 . . . . 0.0 110.977 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.52 HG23 ' HD2' ' A' ' 49' ' ' PRO . 4.0 t -175.12 137.66 0.41 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.631 -179.823 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.738 ' N ' ' HD3' ' A' ' 49' ' ' PRO . 56.5 m -118.54 30.43 0.15 Allowed Pre-proline 0 CA--C 1.537 0.479 0 N-CA-C 113.3 0.852 . . . . 0.0 113.3 -179.664 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.738 ' HD3' ' N ' ' A' ' 48' ' ' CYS . 36.3 Cg_exo -59.05 -16.57 33.59 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 121.703 1.602 . . . . 0.0 111.971 179.068 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 6.6 t -38.17 131.71 1.11 Allowed 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.78 -179.614 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 23.0 mtmm -166.59 -38.98 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.092 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.51 ' H ' ' HD2' ' A' ' 53' ' ' PRO . 0.0 OUTLIER -117.81 -67.24 0.02 OUTLIER Pre-proline 0 CA--C 1.533 0.299 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.785 -179.416 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 53' ' ' PRO . . . . . 0.51 ' HD2' ' H ' ' A' ' 52' ' ' LYS . 21.8 Cg_endo -60.45 -85.43 0.01 OUTLIER 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.137 1.891 . . . . 0.0 112.534 -179.43 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.47 0.536 0 CA-C-O 120.9 0.381 . . . . 0.0 110.673 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.23 0.072 0 CA-C-O 120.746 0.308 . . . . 0.0 110.693 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' CYS . . . . . 0.591 ' HB2' HD22 ' A' ' 22' ' ' LEU . 9.1 p -46.39 -30.17 2.01 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.361 -0.382 . . . . 0.0 111.064 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.501 ' O ' ' CB ' ' A' ' 61' ' ' SER . 0.0 OUTLIER 74.16 172.7 0.28 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.748 179.939 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.501 ' CB ' ' O ' ' A' ' 60' ' ' CYS . 2.8 p 154.06 68.3 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.557 -179.814 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -161.78 173.44 14.61 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.041 -179.899 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -68.85 -42.2 77.43 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.811 179.901 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.437 ' HD2' ' CD2' ' A' ' 4' ' ' HIS . 40.5 mmtm -116.76 84.31 2.12 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.719 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -73.19 -27.09 61.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.178 -179.883 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -128.23 74.09 79.58 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.072 -179.883 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 15.3 Cg_exo -68.57 67.57 1.13 Allowed 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.803 2.335 . . . . 0.0 112.335 -179.817 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 2.5 m-70 61.7 153.94 0.11 Allowed Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.032 179.774 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -59.18 -162.22 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.675 2.25 . . . . 0.0 112.19 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.539 ' O ' ' C ' ' A' ' 71' ' ' GLN . 0.0 OUTLIER -121.91 -33.19 3.6 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.491 179.833 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.539 ' C ' ' O ' ' A' ' 70' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.473 0.72 0 N-CA-C 112.785 0.661 . . . . 0.0 112.785 179.908 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 192' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.502 -0.899 0 CA-C-O 122.23 1.014 . . . . 0.0 111.557 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 193' ' ' CYS . . . . . 0.583 ' N ' ' CD ' ' B' ' 194' ' ' PRO . 0.5 OUTLIER -144.12 35.29 0.19 Allowed Pre-proline 0 N--CA 1.43 -1.475 0 CA-C-N 113.025 -1.898 . . . . 0.0 112.826 -172.851 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 194' ' ' PRO . . . . . 0.583 ' CD ' ' N ' ' B' ' 193' ' ' CYS . 92.6 Cg_endo -79.89 -34.31 0.96 Allowed 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 122.312 2.008 . . . . 0.0 112.454 179.821 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 195' ' ' ASP . . . . . 0.416 ' C ' ' HD3' ' B' ' 197' ' ' PRO . 36.9 t70 -112.64 39.8 2.41 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.402 -179.531 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 196' ' ' THR . . . . . 0.753 ' N ' ' HD3' ' B' ' 197' ' ' PRO . 15.1 t -112.4 21.78 0.08 OUTLIER Pre-proline 0 CA--C 1.531 0.245 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 179.914 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 197' ' ' PRO . . . . . 0.753 ' HD3' ' N ' ' B' ' 196' ' ' THR . 8.0 Cg_exo -67.36 16.4 0.12 Allowed 'Trans proline' 0 C--N 1.357 1.025 0 CA-C-N 120.427 1.188 . . . . 0.0 109.593 176.304 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 198' ' ' TYR . . . . . 0.681 ' H ' ' C ' ' B' ' 196' ' ' THR . 38.4 t80 . . . . . 0 C--O 1.25 1.106 0 CA-C-N 114.554 -1.203 . . . . 0.0 111.23 -178.939 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 1' ' ' ILE . . . . . 0.443 HG22 ' HG2' ' A' ' 64' ' ' LYS . 6.8 mm . . . . . 0 N--CA 1.487 1.381 0 CA-C-O 120.822 0.344 . . . . 0.0 111.009 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 2' ' ' VAL . . . . . 0.534 ' C ' ' HG3' ' A' ' 64' ' ' LYS . 95.8 t -129.35 138.44 54.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.565 179.602 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.51 ' N ' ' HG3' ' A' ' 64' ' ' LYS . 1.3 m -84.11 -174.56 5.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.507 -178.891 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 4' ' ' HIS . . . . . 0.464 ' N ' ' CD2' ' A' ' 4' ' ' HIS . 0.0 OUTLIER -149.05 127.08 11.95 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.236 179.648 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -45.99 -50.19 15.18 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.151 -179.82 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.563 HG22 ' O ' ' A' ' 6' ' ' THR . 21.8 m 47.34 28.1 1.01 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.92 179.471 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.39 -70.1 0.19 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.057 0.456 . . . . 0.0 110.535 179.546 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 1.1 p . . . . . 0 C--N 1.328 -0.355 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.133 179.238 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo . . . . . 0 CA--C 1.531 0.337 0 N-CA-C 112.83 0.281 . . . . 0.0 112.83 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -59.16 -60.54 0.32 Allowed 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.841 2.36 . . . . 0.0 112.826 -179.596 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -58.84 -141.26 0.01 OUTLIER Glycine 0 CA--C 1.518 0.261 0 CA-C-N 116.004 -0.544 . . . . 0.0 113.116 -179.262 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -57.11 -163.74 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.751 0.31 . . . . 0.0 111.234 -179.672 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 4.8 m120 74.23 69.54 0.1 Allowed 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.764 -179.856 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.43 HD13 ' HZ3' ' A' ' 64' ' ' LYS . 3.4 mm? -86.41 178.85 6.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.961 -179.969 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.539 ' HA ' ' HA ' ' A' ' 44' ' ' CYS . 0.8 OUTLIER -55.01 171.44 0.14 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.098 0.475 . . . . 0.0 111.855 -179.266 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.85 ' CD1' ' HB2' ' A' ' 45' ' ' ALA . 0.0 OUTLIER -109.61 -162.55 0.81 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.731 -179.655 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -165.88 69.2 0.12 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.962 179.695 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.467 ' O ' ' HG3' ' A' ' 26' ' ' LYS . 11.6 tptm -95.39 62.44 2.44 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.814 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' MET . . . . . 0.452 ' HE1' ' HD3' ' A' ' 70' ' ' LYS . 6.4 ttt -97.09 90.59 5.21 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 10.7 t-105 -39.78 -86.5 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 -178.948 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 10.4 t 72.76 154.01 0.14 Allowed 'General case' 0 N--CA 1.462 0.172 0 CA-C-O 120.691 0.282 . . . . 0.0 110.513 -179.554 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -121.29 111.61 17.58 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.869 0.366 . . . . 0.0 111.367 -179.596 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . 57.15 -86.39 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.348 179.683 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 6.3 p90 -108.15 131.31 54.77 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.896 0.379 . . . . 0.0 110.805 -179.845 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -86.44 -166.23 1.49 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.904 -179.969 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 76.42 99.37 0.07 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.354 -179.551 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 4.7 p 60.83 32.12 20.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.539 -179.51 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 9.1 tpt85 -96.1 -84.99 0.34 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.214 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -123.4 -14.63 3.93 Favored Glycine 0 C--N 1.334 0.459 0 C-N-CA 120.388 -0.91 . . . . 0.0 113.56 -179.504 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.475 ' HA ' ' HG3' ' A' ' 70' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.331 -0.226 0 CA-C-N 117.188 0.494 . . . . 0.0 110.434 -179.621 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.672 0 CA-C-O 120.037 -0.313 . . . . 0.0 113.584 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.539 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 1.3 m 61.06 150.42 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 117.379 0.589 . . . . 0.0 111.222 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.85 ' HB2' ' CD1' ' A' ' 24' ' ' TYR . . . -135.2 -167.74 2.06 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.481 -179.445 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -114.78 -28.33 7.12 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.899 179.527 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.723 HG23 ' HD3' ' A' ' 49' ' ' PRO . 1.8 t -158.09 -120.49 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.464 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.423 ' N ' ' OG1' ' A' ' 47' ' ' THR . 2.1 t -178.01 65.19 0.19 Allowed Pre-proline 0 C--O 1.231 0.119 0 CA-C-O 120.812 0.339 . . . . 0.0 111.103 -179.921 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.723 ' HD3' HG23 ' A' ' 47' ' ' THR . 96.4 Cg_endo -78.78 14.33 1.71 Allowed 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.575 2.184 . . . . 0.0 111.544 178.811 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 31.5 t -61.0 135.71 57.87 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.584 -0.734 . . . . 0.0 111.415 -179.608 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 6.4 pttt 171.15 44.15 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.687 179.72 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.56 165.63 17.16 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.875 -179.87 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_exo -60.03 -68.08 0.05 OUTLIER 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 122.562 2.175 . . . . 0.0 112.339 -179.831 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.468 0.447 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.53 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 71.9 p . . . . . 0 N--CA 1.468 0.447 0 N-CA-C 112.512 0.56 . . . . 0.0 112.512 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 2.6 p -51.96 -173.79 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.919 -179.509 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.402 ' HB3' ' CB ' ' A' ' 23' ' ' CYS . 0.6 OUTLIER -163.56 70.08 0.22 Allowed 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.616 179.992 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.564 ' O ' ' HB ' ' A' ' 62' ' ' THR . 9.7 p -88.21 128.68 35.46 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.6 -179.492 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.564 ' HB ' ' O ' ' A' ' 61' ' ' SER . 6.0 t 144.41 -146.13 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 108.458 -0.942 . . . . 0.0 108.458 -179.758 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ASP . . . . . 0.425 ' N ' ' OG1' ' A' ' 62' ' ' THR . 19.9 m-20 -74.38 55.39 0.62 Allowed 'General case' 0 C--N 1.332 -0.196 0 N-CA-C 109.684 -0.488 . . . . 0.0 109.684 178.581 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.534 ' HG3' ' C ' ' A' ' 2' ' ' VAL . 1.7 mmtp 36.05 45.46 0.31 Allowed 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 115.387 -0.824 . . . . 0.0 112.479 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' CYS . . . . . 0.471 ' HB2' ' HD3' ' A' ' 67' ' ' PRO . 0.0 OUTLIER 50.19 -82.63 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 115.481 -0.781 . . . . 0.0 112.301 178.651 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.475 ' N ' ' HD3' ' A' ' 67' ' ' PRO . 6.0 t30 52.98 57.61 14.56 Favored Pre-proline 0 CA--C 1.532 0.283 0 CA-C-O 120.752 0.311 . . . . 0.0 111.178 -179.589 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' PRO . . . . . 0.475 ' HD3' ' N ' ' A' ' 66' ' ' ASN . 63.8 Cg_endo -92.38 18.3 1.11 Allowed 'Trans proline' 0 N--CA 1.458 -0.616 0 C-N-CA 122.98 2.453 . . . . 0.0 113.142 -179.552 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.413 ' HB3' ' HD2' ' A' ' 69' ' ' PRO . 79.7 m80 60.83 158.63 0.11 Allowed Pre-proline 0 C--N 1.33 -0.243 0 CA-C-N 116.698 -0.228 . . . . 0.0 110.65 -179.793 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' PRO . . . . . 0.446 ' O ' ' N ' ' A' ' 71' ' ' GLN . 58.8 Cg_endo -71.82 64.12 3.18 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.424 2.082 . . . . 0.0 112.506 -179.706 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.475 ' HG3' ' HA ' ' A' ' 38' ' ' LYS . 2.4 mmmm 50.67 -87.66 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.174 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.446 ' N ' ' O ' ' A' ' 69' ' ' PRO . 8.2 tp-100 . . . . . 0 CA--C 1.529 0.173 0 CA-C-N 116.641 -0.254 . . . . 0.0 111.682 179.409 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 192' ' ' CYS . . . . . 0.701 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.5 OUTLIER . . . . . 0 CA--C 1.497 -1.059 0 CA-C-O 122.045 0.926 . . . . 0.0 111.473 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 193' ' ' CYS . . . . . 0.701 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.0 OUTLIER -155.3 166.7 15.64 Favored Pre-proline 0 N--CA 1.435 -1.203 0 CA-C-N 113.44 -1.709 . . . . 0.0 111.574 -173.647 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 194' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -74.23 -162.41 0.14 Allowed 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.613 2.208 . . . . 0.0 112.365 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -133.64 58.52 1.77 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.249 179.622 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 196' ' ' THR . . . . . 0.733 ' N ' ' HD3' ' B' ' 197' ' ' PRO . 16.0 p -101.82 12.13 0.06 OUTLIER Pre-proline 0 CA--C 1.534 0.347 0 N-CA-C 113.893 1.072 . . . . 0.0 113.893 -179.508 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 197' ' ' PRO . . . . . 0.733 ' HD3' ' N ' ' B' ' 196' ' ' THR . 13.5 Cg_exo -66.47 22.78 0.1 OUTLIER 'Trans proline' 0 C--N 1.359 1.116 0 CA-C-N 121.014 1.398 . . . . 0.0 109.934 176.85 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 198' ' ' TYR . . . . . 0.721 ' H ' ' C ' ' B' ' 196' ' ' THR . 35.4 t80 . . . . . 0 C--O 1.248 1.011 0 CA-C-N 114.584 -1.189 . . . . 0.0 111.281 -178.797 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 1' ' ' ILE . . . . . 0.42 ' CG1' ' HA ' ' A' ' 63' ' ' ASP . 1.0 OUTLIER . . . . . 0 N--CA 1.487 1.38 0 CA-C-O 120.396 0.141 . . . . 0.0 110.924 . . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 2' ' ' VAL . . . . . 0.507 HG12 ' N ' ' A' ' 3' ' ' CYS . 84.1 t -42.49 159.7 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.462 0.171 0 CA-C-O 120.528 0.204 . . . . 0.0 111.29 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.507 ' N ' HG12 ' A' ' 2' ' ' VAL . 49.7 t -158.06 41.89 0.28 Allowed 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 112.582 0.586 . . . . 0.0 112.582 -178.716 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 4' ' ' HIS . . . . . 0.438 ' CE1' ' HB2' ' A' ' 64' ' ' LYS . 0.1 OUTLIER 49.95 -176.91 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.82 0.343 . . . . 0.0 111.687 179.105 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 17.1 p -63.55 -132.05 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.7 179.782 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 6.4 p -96.15 30.84 2.33 Favored 'General case' 0 CA--C 1.528 0.121 0 CA-C-O 120.812 0.339 . . . . 0.0 111.106 -179.857 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 60.93 52.75 4.02 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.911 0.386 . . . . 0.0 111.098 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 25.5 p . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.721 179.913 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.453 ' N ' ' CD ' ' A' ' 18' ' ' PRO . 37.1 Cg_exo . . . . . 0 CA--C 1.53 0.282 0 CA-C-O 120.481 0.117 . . . . 0.0 112.378 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.453 ' CD ' ' N ' ' A' ' 17' ' ' PRO . 77.2 Cg_endo -87.16 174.22 5.39 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 122.742 2.295 . . . . 0.0 112.471 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 52.98 -167.06 1.19 Allowed Glycine 0 C--N 1.331 0.276 0 C-N-CA 120.913 -0.66 . . . . 0.0 112.855 179.795 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.62 ' HB2' ' HB2' ' A' ' 46' ' ' ALA . 0.3 OUTLIER -100.21 -153.81 0.46 Allowed 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 110.449 -0.204 . . . . 0.0 110.449 179.813 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ASN . . . . . 0.436 ' C ' HD22 ' A' ' 22' ' ' LEU . 28.9 p-10 -106.19 64.8 0.68 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.748 0.308 . . . . 0.0 111.541 -179.574 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.557 HD13 ' CB ' ' A' ' 61' ' ' SER . 4.1 mm? -112.89 7.57 18.35 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.295 179.541 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.708 ' HB3' ' HB3' ' A' ' 60' ' ' CYS . 40.0 t 24.19 43.69 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.477 0.711 . . . . 0.0 112.623 179.867 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.617 ' HB3' ' HA3' ' A' ' 43' ' ' GLY . 0.0 OUTLIER -36.32 91.52 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.87 178.733 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.465 ' N ' ' O ' ' A' ' 23' ' ' CYS . 2.0 ptt180 -97.18 98.62 10.18 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.883 0.373 . . . . 0.0 111.28 -179.242 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.53 177.4 2.45 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.088 -0.505 . . . . 0.0 109.713 179.195 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 18.1 ttp -176.77 164.47 2.41 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.806 0.336 . . . . 0.0 110.703 179.812 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 2.4 t90 -105.74 -137.15 0.36 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.279 179.828 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 71.15 -162.73 0.14 Allowed 'General case' 0 CA--C 1.529 0.165 0 CA-C-O 120.682 0.277 . . . . 0.0 110.558 -179.912 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.538 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 0.1 OUTLIER 173.72 37.36 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.96 179.875 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.538 ' HB3' ' O ' ' A' ' 30' ' ' ASP . . . 76.29 -54.52 0.6 Allowed 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.498 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -46.24 -28.71 1.35 Allowed 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 111.815 0.302 . . . . 0.0 111.815 -179.591 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -83.84 133.81 34.73 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.87 0.367 . . . . 0.0 110.62 179.784 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 74.2 p -64.42 76.93 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.313 -179.638 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 29.6 t 49.15 59.9 4.13 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.287 179.695 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.406 ' C ' ' HD3' ' A' ' 38' ' ' LYS . 4.9 mmm-85 -101.98 -107.53 0.24 Allowed 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.686 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.447 ' O ' ' HG2' ' A' ' 38' ' ' LYS . . . 76.22 -95.38 1.06 Allowed Glycine 0 C--N 1.335 0.482 0 C-N-CA 120.607 -0.806 . . . . 0.0 113.115 179.745 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.447 ' HG2' ' O ' ' A' ' 37' ' ' GLY . 0.0 OUTLIER . . . . . 0 N--CA 1.468 0.428 0 N-CA-C 112.615 0.598 . . . . 0.0 112.615 -179.574 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' GLY . . . . . 0.617 ' HA3' ' HB3' ' A' ' 24' ' ' TYR . . . . . . . . 0 N--CA 1.449 -0.456 0 CA-C-O 120.465 -0.075 . . . . 0.0 113.259 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.515 ' H ' ' N ' ' A' ' 24' ' ' TYR . 0.5 OUTLIER 55.44 79.34 0.16 Allowed 'General case' 0 CA--C 1.531 0.221 0 CA-C-O 120.764 0.316 . . . . 0.0 110.684 -179.29 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.436 ' HB3' ' CD1' ' A' ' 24' ' ' TYR . . . -96.52 -160.7 0.81 Allowed 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.492 -179.51 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.62 ' HB2' ' HB2' ' A' ' 20' ' ' GLU . . . -167.28 50.41 0.06 Allowed 'General case' 0 C--N 1.333 -0.115 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.452 -179.705 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.79 HG23 ' HD3' ' A' ' 49' ' ' PRO . 0.0 OUTLIER 178.41 -33.2 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.137 179.871 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.604 ' N ' ' HD3' ' A' ' 49' ' ' PRO . 85.5 m 68.66 34.32 0.1 Allowed Pre-proline 0 CA--C 1.534 0.341 0 N-CA-C 113.519 0.933 . . . . 0.0 113.519 179.135 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.79 ' HD3' HG23 ' A' ' 47' ' ' THR . 44.1 Cg_endo -88.88 13.97 2.37 Favored 'Trans proline' 0 C--N 1.35 0.608 0 C-N-CA 122.08 1.853 . . . . 0.0 110.894 178.106 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.493 ' O ' ' HB2' ' A' ' 51' ' ' LYS . 0.3 OUTLIER -97.05 42.33 1.09 Allowed 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 115.247 -0.888 . . . . 0.0 111.547 -178.726 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.493 ' HB2' ' O ' ' A' ' 50' ' ' SER . 12.5 mttt 74.56 162.53 0.26 Allowed 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.667 -179.638 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.584 ' HB2' ' CD ' ' A' ' 53' ' ' PRO . 0.1 OUTLIER -128.72 -70.51 0.02 OUTLIER Pre-proline 0 CA--C 1.534 0.363 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.891 -179.602 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 53' ' ' PRO . . . . . 0.584 ' CD ' ' HB2' ' A' ' 52' ' ' LYS . 36.8 Cg_endo -66.67 -61.94 0.08 OUTLIER 'Trans proline' 0 C--N 1.352 0.715 0 C-N-CA 121.987 1.791 . . . . 0.0 112.9 -179.641 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' TYR . . . . . 0.448 ' CE1' ' HG2' ' A' ' 53' ' ' PRO . 0.0 OUTLIER . . . . . 0 N--CA 1.471 0.597 0 CA-C-O 120.916 0.389 . . . . 0.0 111.649 -179.573 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 45.1 p . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.763 0.316 . . . . 0.0 111.045 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 59' ' ' CYS . . . . . 0.461 ' HA ' ' CD1' ' A' ' 24' ' ' TYR . 2.5 m 50.78 -177.3 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.814 -179.759 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.708 ' HB3' ' HB3' ' A' ' 23' ' ' CYS . 2.2 t -141.19 -94.81 0.14 Allowed 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 116.635 -0.257 . . . . 0.0 110.862 -179.858 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.557 ' CB ' HD13 ' A' ' 22' ' ' LEU . 1.6 t 54.25 172.75 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.164 0 CA-C-O 120.892 0.377 . . . . 0.0 111.56 179.394 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.402 ' N ' ' OG ' ' A' ' 61' ' ' SER . 1.2 m 74.64 79.07 0.11 Allowed 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.243 179.679 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ASP . . . . . 0.42 ' HA ' ' CG1' ' A' ' 1' ' ' ILE . 11.5 m-20 52.36 -178.39 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.972 179.881 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.438 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 0.0 OUTLIER -57.35 88.79 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.683 179.851 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 3.2 p -92.13 42.56 1.11 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.466 -179.825 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.417 ' O ' ' CD2' ' A' ' 68' ' ' HIS . 2.3 m-20 -106.67 87.46 2.81 Favored Pre-proline 0 C--N 1.326 -0.433 0 C-N-CA 120.897 -0.321 . . . . 0.0 110.651 179.582 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -73.03 -4.6 15.71 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.727 2.285 . . . . 0.0 113.069 -179.64 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.441 ' HB3' ' HD2' ' A' ' 69' ' ' PRO . 0.3 OUTLIER 64.29 178.56 0.05 OUTLIER Pre-proline 0 C--N 1.331 -0.221 0 N-CA-C 110.396 -0.224 . . . . 0.0 110.396 -179.763 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 69' ' ' PRO . . . . . 0.441 ' HD2' ' HB3' ' A' ' 68' ' ' HIS . 77.7 Cg_exo -50.24 123.22 10.67 Favored 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.377 2.051 . . . . 0.0 112.479 -179.84 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.28 29.97 2.99 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.919 179.868 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.415 ' HB3' ' CE ' ' A' ' 38' ' ' LYS . 1.5 pp0? . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.068 -179.857 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 192' ' ' CYS . . . . . 0.714 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.0 OUTLIER . . . . . 0 CA--C 1.498 -1.043 0 CA-C-O 122.284 1.04 . . . . 0.0 112.038 . . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 193' ' ' CYS . . . . . 0.714 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.0 OUTLIER 44.72 49.79 6.35 Favored Pre-proline 0 N--CA 1.435 -1.201 0 CA-C-N 113.073 -1.876 . . . . 0.0 112.412 174.05 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 194' ' ' PRO . . . . . 0.507 ' HD3' ' N ' ' B' ' 193' ' ' CYS . 64.0 Cg_endo -87.24 -25.21 1.09 Allowed 'Trans proline' 0 N--CA 1.459 -0.531 0 C-N-CA 122.596 2.197 . . . . 0.0 112.362 179.671 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -94.69 -173.86 3.13 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.265 -179.611 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 196' ' ' THR . . . . . 0.643 ' N ' ' HD3' ' B' ' 197' ' ' PRO . 0.2 OUTLIER -160.36 48.78 0.26 Allowed Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.634 -179.915 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 197' ' ' PRO . . . . . 0.643 ' HD3' ' N ' ' B' ' 196' ' ' THR . 6.0 Cg_exo -74.93 16.75 0.63 Allowed 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 121.879 1.719 . . . . 0.0 108.768 176.182 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 198' ' ' TYR . . . . . 0.58 ' H ' ' C ' ' B' ' 196' ' ' THR . 11.9 t80 . . . . . 0 C--O 1.25 1.08 0 CA-C-N 113.771 -1.559 . . . . 0.0 111.326 -178.659 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.382 0 CA-C-O 120.816 0.341 . . . . 0.0 111.01 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 2' ' ' VAL . . . . . 0.513 HG12 ' N ' ' A' ' 3' ' ' CYS . 60.9 t 63.4 159.19 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.826 -179.653 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.513 ' N ' HG12 ' A' ' 2' ' ' VAL . 38.6 m -96.05 177.4 5.75 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.666 -179.657 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 4' ' ' HIS . . . . . 0.491 ' NE2' ' O ' ' A' ' 63' ' ' ASP . 0.0 OUTLIER -135.62 160.97 36.85 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.652 -0.249 . . . . 0.0 110.594 179.835 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.452 ' C ' ' O ' ' A' ' 4' ' ' HIS . 20.5 p -21.96 134.43 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 113.373 0.879 . . . . 0.0 113.373 -179.753 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 3.7 t -101.02 -15.13 17.56 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.266 178.852 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.729 ' HB1' ' HG3' ' B' ' 194' ' ' PRO . . . -63.85 -161.73 0.01 OUTLIER 'General case' 0 C--O 1.232 0.142 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.905 179.718 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.595 HG21 ' HB3' ' B' ' 197' ' ' PRO . 2.8 t . . . . . 0 CA--C 1.531 0.234 0 CA-C-N 116.81 -0.177 . . . . 0.0 111.3 179.787 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo . . . . . 0 N--CA 1.46 -0.449 0 N-CA-C 112.716 0.237 . . . . 0.0 112.716 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -78.0 -63.34 0.03 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.572 0 C-N-CA 122.263 1.976 . . . . 0.0 111.709 179.375 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -134.3 17.01 4.33 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.96 -0.638 . . . . 0.0 112.191 179.32 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.425 ' O ' ' CG ' ' A' ' 21' ' ' ASN . 0.0 OUTLIER 173.17 -165.88 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.702 0.287 . . . . 0.0 110.729 -179.895 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ASN . . . . . 0.488 ' HA ' ' HA ' ' A' ' 46' ' ' ALA . 1.4 p30 67.18 3.93 3.42 Favored 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 112.718 0.636 . . . . 0.0 112.718 179.576 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.679 HD22 ' HB2' ' A' ' 61' ' ' SER . 0.8 OUTLIER 39.04 -161.89 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 178.881 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.461 ' H ' ' H ' ' A' ' 61' ' ' SER . 0.1 OUTLIER -121.28 -11.41 8.8 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.008 -179.935 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.556 ' HB2' ' H ' ' A' ' 44' ' ' CYS . 0.9 OUTLIER 46.54 -174.83 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 120.785 0.326 . . . . 0.0 111.229 -179.738 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.461 ' CD ' ' HG3' ' A' ' 67' ' ' PRO . 14.3 ttt-85 172.56 94.77 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.892 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.411 ' CG ' ' N ' ' A' ' 27' ' ' MET . 0.3 OUTLIER -62.11 163.97 7.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.276 179.483 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 27' ' ' MET . . . . . 0.411 ' N ' ' CG ' ' A' ' 26' ' ' LYS . 66.0 ttp -153.71 163.27 40.29 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.607 179.685 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' TRP . . . . . 0.417 ' CE3' ' HB3' ' A' ' 30' ' ' ASP . 0.0 OUTLIER -114.98 -74.15 0.62 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.06 179.963 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 1.5 m 60.32 52.0 5.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.913 0.387 . . . . 0.0 110.715 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.417 ' HB3' ' CE3' ' A' ' 28' ' ' TRP . 3.6 p30 -87.41 157.5 19.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.097 -179.85 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . 57.16 52.44 8.99 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.162 179.712 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER 56.26 97.43 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.795 179.962 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.42 ' O ' ' N ' ' A' ' 35' ' ' SER . 0.3 OUTLIER -56.56 -73.72 0.06 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.058 -179.827 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 16.3 t 55.08 -85.89 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.014 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.42 ' N ' ' O ' ' A' ' 33' ' ' CYS . 56.7 p -101.09 23.82 10.26 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.867 0.365 . . . . 0.0 110.769 179.663 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.411 ' CA ' ' HE3' ' A' ' 70' ' ' LYS . 0.2 OUTLIER -119.7 -163.07 0.96 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.499 179.987 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 122.01 11.38 5.83 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.545 -0.836 . . . . 0.0 112.85 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.245 0 CA-C-O 121.037 0.446 . . . . 0.0 110.762 179.797 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' GLY . . . . . 0.457 ' HA3' ' CB ' ' A' ' 24' ' ' TYR . . . . . . . . 0 N--CA 1.45 -0.405 0 CA-C-O 120.289 -0.173 . . . . 0.0 113.184 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.556 ' H ' ' HB2' ' A' ' 24' ' ' TYR . 24.3 t 51.86 86.94 0.03 OUTLIER 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 117.081 0.44 . . . . 0.0 110.166 -179.539 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.424 ' O ' ' HA ' ' A' ' 21' ' ' ASN . . . -153.56 155.91 37.04 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.966 0.412 . . . . 0.0 111.989 -178.97 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.488 ' HA ' ' HA ' ' A' ' 21' ' ' ASN . . . -85.66 80.13 9.11 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.436 179.941 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.45 ' OG1' ' N ' ' A' ' 48' ' ' CYS . 0.6 OUTLIER -170.58 -179.61 2.99 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.649 179.831 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.676 ' O ' ' N ' ' A' ' 50' ' ' SER . 0.5 OUTLIER 179.02 -48.24 0.0 OUTLIER Pre-proline 0 C--N 1.333 -0.148 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.568 179.934 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.426 ' CD ' ' N ' ' A' ' 48' ' ' CYS . 53.8 Cg_exo -52.28 72.56 0.02 OUTLIER 'Trans proline' 0 C--N 1.351 0.694 0 C-N-CA 122.083 1.855 . . . . 0.0 111.067 179.685 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.676 ' N ' ' O ' ' A' ' 48' ' ' CYS . 28.7 t -118.63 -80.01 0.61 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.378 -0.828 . . . . 0.0 111.258 -178.342 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 10.2 mtmm 58.91 34.21 23.51 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.836 0.351 . . . . 0.0 111.043 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.41 162.44 33.69 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.809 179.925 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -60.32 -67.84 0.05 OUTLIER 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.494 2.129 . . . . 0.0 112.117 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.468 0.428 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.134 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.143 0 CA-C-O 120.868 0.366 . . . . 0.0 111.35 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' CYS . . . . . 0.489 ' HA ' ' CD1' ' A' ' 24' ' ' TYR . 1.2 m -50.97 138.76 18.67 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.939 179.67 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.611 ' SG ' ' N ' ' A' ' 65' ' ' CYS . 48.5 t -112.07 -83.91 0.58 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.708 -179.593 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.679 ' HB2' HD22 ' A' ' 22' ' ' LEU . 47.0 t 65.65 -148.32 0.22 Allowed 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.138 -179.32 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.528 HG23 ' O ' ' A' ' 61' ' ' SER . 0.2 OUTLIER 49.09 -86.82 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 122.147 0.179 . . . . 0.0 111.22 -179.806 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ASP . . . . . 0.491 ' O ' ' NE2' ' A' ' 4' ' ' HIS . 1.6 p30 -153.64 79.03 1.15 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.666 0.269 . . . . 0.0 111.659 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.5 ' HB2' ' HB3' ' A' ' 3' ' ' CYS . 0.0 OUTLIER 41.19 23.61 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.788 0.662 . . . . 0.0 112.788 179.365 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 65' ' ' CYS . . . . . 0.611 ' N ' ' SG ' ' A' ' 60' ' ' CYS . 0.5 OUTLIER 69.82 -42.39 0.51 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.722 0.296 . . . . 0.0 111.016 179.998 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.617 ' N ' ' HD3' ' A' ' 67' ' ' PRO . 6.0 t30 57.37 53.33 6.29 Favored Pre-proline 0 C--O 1.232 0.179 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.677 -179.659 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 67' ' ' PRO . . . . . 0.617 ' HD3' ' N ' ' A' ' 66' ' ' ASN . 19.5 Cg_endo -92.29 -66.36 0.01 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.945 0 C-N-CA 123.075 2.517 . . . . 0.0 111.521 179.148 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.592 ' HB3' ' HD2' ' A' ' 69' ' ' PRO . 33.5 m80 58.21 166.24 0.07 OUTLIER Pre-proline 0 C--N 1.331 -0.197 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.087 179.148 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' PRO . . . . . 0.592 ' HD2' ' HB3' ' A' ' 68' ' ' HIS . 28.2 Cg_exo -35.15 123.72 0.21 Allowed 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 123.1 2.533 . . . . 0.0 113.145 -179.798 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.413 ' HD3' ' N ' ' A' ' 71' ' ' GLN . 0.0 OUTLIER -98.08 -7.18 30.2 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.236 -179.964 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.413 ' N ' ' HD3' ' A' ' 70' ' ' LYS . 2.1 tt0 . . . . . 0 C--N 1.332 -0.187 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.424 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 192' ' ' CYS . . . . . 0.706 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.5 OUTLIER . . . . . 0 CA--C 1.497 -1.077 0 CA-C-O 121.798 0.809 . . . . 0.0 112.007 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 193' ' ' CYS . . . . . 0.706 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.0 OUTLIER -153.98 103.17 2.46 Favored Pre-proline 0 N--CA 1.436 -1.15 0 CA-C-N 113.734 -1.576 . . . . 0.0 111.964 -173.444 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 194' ' ' PRO . . . . . 0.729 ' HG3' ' HB1' ' A' ' 7' ' ' ALA . 38.3 Cg_endo -81.74 -66.7 0.02 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.768 0 C-N-CA 122.395 2.063 . . . . 0.0 111.979 179.486 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -172.63 14.88 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 113.294 0.85 . . . . 0.0 113.294 179.819 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 196' ' ' THR . . . . . 0.591 ' C ' ' H ' ' B' ' 198' ' ' TYR . 1.4 t -147.2 36.85 0.17 Allowed Pre-proline 0 C--N 1.334 -0.094 0 C-N-CA 120.389 -0.524 . . . . 0.0 112.024 179.725 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 197' ' ' PRO . . . . . 0.595 ' HB3' HG21 ' A' ' 8' ' ' THR . 72.1 Cg_endo -72.2 13.7 0.51 Allowed 'Trans proline' 0 C--N 1.35 0.612 0 C-N-CA 121.518 1.478 . . . . 0.0 109.359 176.113 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 198' ' ' TYR . . . . . 0.591 ' H ' ' C ' ' B' ' 196' ' ' THR . 1.1 t80 . . . . . 0 C--O 1.248 0.976 0 CA-C-N 114.12 -1.4 . . . . 0.0 111.289 -178.926 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 1' ' ' ILE . . . . . 0.733 HD13 HG12 ' A' ' 2' ' ' VAL . 0.1 OUTLIER . . . . . 0 N--CA 1.485 1.309 0 CA-C-O 120.466 0.174 . . . . 0.0 110.812 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 2' ' ' VAL . . . . . 0.733 HG12 HD13 ' A' ' 1' ' ' ILE . 4.0 p 147.44 138.08 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 C-N-CA 123.461 0.705 . . . . 0.0 110.439 179.388 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.487 ' O ' ' C ' ' A' ' 4' ' ' HIS . 0.5 OUTLIER -160.08 54.01 0.34 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.68 -179.719 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 4' ' ' HIS . . . . . 0.487 ' C ' ' O ' ' A' ' 3' ' ' CYS . 4.9 p-80 -23.7 110.31 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 122.659 0.384 . . . . 0.0 112.033 179.627 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.6 t -44.82 149.86 0.4 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.07 -0.513 . . . . 0.0 111.319 -179.642 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.757 HG22 ' HB3' ' A' ' 66' ' ' ASN . 16.8 p -81.01 2.34 27.41 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.448 -179.935 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.507 ' C ' HG23 ' A' ' 8' ' ' THR . . . -58.19 88.69 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.727 0.299 . . . . 0.0 111.205 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.816 HG22 ' O ' ' B' ' 192' ' ' CYS . 1.2 p . . . . . 0 C--N 1.33 -0.262 0 CA-C-O 121.049 0.452 . . . . 0.0 111.206 179.55 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.535 ' CB ' ' HD3' ' A' ' 18' ' ' PRO . 10.5 Cg_exo . . . . . 0 CA--C 1.531 0.352 0 N-CA-C 112.98 0.339 . . . . 0.0 112.98 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.535 ' HD3' ' CB ' ' A' ' 17' ' ' PRO . 43.4 Cg_endo -97.16 -166.5 0.1 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.77 0 C-N-CA 122.818 2.345 . . . . 0.0 112.795 -179.4 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 78.33 -65.4 3.37 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.801 179.48 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -113.32 156.42 23.4 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.978 0.418 . . . . 0.0 111.207 -179.577 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ASN . . . . . 0.724 ' O ' HD13 ' A' ' 22' ' ' LEU . 0.2 OUTLIER -103.3 40.21 1.44 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.62 179.871 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.724 HD13 ' O ' ' A' ' 21' ' ' ASN . 0.6 OUTLIER 165.82 -172.99 0.02 OUTLIER 'General case' 0 N--CA 1.461 0.121 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.033 -179.692 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.575 ' HB2' ' C ' ' A' ' 60' ' ' CYS . 1.6 m -120.32 88.55 2.96 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.429 0.633 . . . . 0.0 111.292 -179.835 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.536 ' CD2' ' HB3' ' A' ' 45' ' ' ALA . 14.7 t80 -78.51 125.38 29.29 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.063 -0.971 . . . . 0.0 112.201 -179.254 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.659 ' NH1' HG22 ' A' ' 58' ' ' THR . 0.0 OUTLIER -155.97 137.72 14.29 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.651 -0.25 . . . . 0.0 110.653 179.263 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 4.5 mttt -80.04 145.25 32.58 Favored 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 120.901 -0.32 . . . . 0.0 110.922 -179.831 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' MET . . . . . 0.457 ' HE1' ' HG2' ' A' ' 67' ' ' PRO . 50.1 tpp -153.49 146.05 24.14 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.332 -179.783 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' TRP . . . . . 0.445 ' O ' ' CB ' ' A' ' 29' ' ' CYS . 0.3 OUTLIER -149.04 -160.54 1.19 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.768 179.88 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 29' ' ' CYS . . . . . 0.641 ' HA ' ' HB3' ' A' ' 33' ' ' CYS . 0.1 OUTLIER 85.68 -17.6 0.4 Allowed 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 122.806 0.442 . . . . 0.0 111.724 -179.921 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.41 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 41.1 m-20 -54.19 126.73 24.05 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.776 0.322 . . . . 0.0 110.978 -179.91 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.41 ' HB3' ' O ' ' A' ' 30' ' ' ASP . . . 67.28 -72.29 0.09 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.878 -179.793 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.452 ' O ' ' SG ' ' A' ' 33' ' ' CYS . 18.6 m-85 -71.63 -164.24 0.12 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.34 179.647 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.641 ' HB3' ' HA ' ' A' ' 29' ' ' CYS . 0.5 OUTLIER 74.51 -50.12 0.67 Allowed 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 112.094 0.405 . . . . 0.0 112.094 179.554 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.402 ' N ' ' SG ' ' A' ' 33' ' ' CYS . 0.3 OUTLIER 53.73 55.6 8.28 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.871 0.367 . . . . 0.0 110.685 -179.854 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 67.28 35.2 4.5 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.14 -179.811 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -144.71 12.8 1.49 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.866 -179.909 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.432 ' N ' ' HB2' ' A' ' 33' ' ' CYS . . . -87.7 -52.39 3.0 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.647 -0.787 . . . . 0.0 112.862 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.468 0.435 0 CA-C-O 120.839 0.352 . . . . 0.0 111.111 -179.677 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.554 0 N-CA-C 110.165 -1.174 . . . . 0.0 110.165 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.507 ' N ' ' O ' ' A' ' 24' ' ' TYR . 0.1 OUTLIER 76.57 109.29 0.08 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.041 0.448 . . . . 0.0 110.49 -178.155 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.551 ' O ' ' N ' ' A' ' 47' ' ' THR . . . -173.5 147.11 1.42 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.137 -179.668 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.512 ' C ' HG22 ' A' ' 47' ' ' THR . . . 47.33 -82.43 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.709 179.394 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.551 ' N ' ' O ' ' A' ' 45' ' ' ALA . 1.2 t 156.76 62.19 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.402 179.821 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.537 ' CB ' HD23 ' A' ' 22' ' ' LEU . 49.6 t 43.91 53.51 10.41 Favored Pre-proline 0 N--CA 1.466 0.375 0 N-CA-C 111.787 0.292 . . . . 0.0 111.787 179.688 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.515 ' HD3' ' N ' ' A' ' 48' ' ' CYS . 37.4 Cg_exo -55.0 -25.45 44.6 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 121.984 1.789 . . . . 0.0 111.002 179.088 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 3.0 t -55.78 179.95 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.206 -0.906 . . . . 0.0 111.323 179.751 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 11.8 ptpt 175.89 -47.72 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.035 179.881 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.436 ' HB2' ' CE2' ' A' ' 54' ' ' TYR . 0.0 OUTLIER -75.02 149.27 85.08 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.974 -179.898 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -59.32 -47.66 16.34 Favored 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.59 2.194 . . . . 0.0 112.364 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' TYR . . . . . 0.436 ' CE2' ' HB2' ' A' ' 52' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.471 0.593 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.996 -179.751 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.659 HG22 ' NH1' ' A' ' 25' ' ' ARG . 8.9 t . . . . . 0 C--O 1.232 0.167 0 CA-C-O 120.72 0.295 . . . . 0.0 110.425 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -101.29 134.78 43.82 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.872 0.367 . . . . 0.0 110.292 179.681 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.575 ' C ' ' HB2' ' A' ' 23' ' ' CYS . 0.5 OUTLIER -123.45 15.68 9.65 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.448 -179.418 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.584 ' O ' HG23 ' A' ' 62' ' ' THR . 0.3 OUTLIER -64.94 95.16 0.15 Allowed 'General case' 0 C--N 1.333 -0.116 0 CA-C-O 121.057 0.456 . . . . 0.0 111.289 -179.123 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.584 HG23 ' O ' ' A' ' 61' ' ' SER . 0.1 OUTLIER 168.39 67.81 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.377 179.826 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ASP . . . . . 0.621 ' HA ' HG13 ' A' ' 2' ' ' VAL . 1.2 t0 64.81 -163.91 0.25 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.551 -179.737 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.416 ' HB3' ' CE1' ' A' ' 4' ' ' HIS . 0.0 OUTLIER -60.74 87.59 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.88 0.371 . . . . 0.0 110.306 179.864 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 16.7 t -94.95 -50.01 5.3 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.941 -179.735 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.757 ' HB3' HG22 ' A' ' 6' ' ' THR . 29.4 m-20 -43.29 100.47 0.23 Allowed Pre-proline 0 N--CA 1.463 0.201 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.533 -179.761 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' PRO . . . . . 0.457 ' HG2' ' HE1' ' A' ' 27' ' ' MET . 95.6 Cg_endo -90.89 131.57 1.53 Allowed 'Trans proline' 0 N--CA 1.454 -0.797 0 C-N-CA 122.732 2.288 . . . . 0.0 112.059 -180.0 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 5.7 p80 -48.0 161.49 0.36 Allowed Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.726 179.83 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -47.21 173.07 0.03 OUTLIER 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.429 2.086 . . . . 0.0 112.083 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.436 ' O ' ' C ' ' A' ' 71' ' ' GLN . 0.0 OUTLIER -54.47 -27.35 36.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.034 -179.817 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.436 ' C ' ' O ' ' A' ' 70' ' ' LYS . 22.8 tp60 . . . . . 0 N--CA 1.469 0.487 0 O-C-N 123.571 0.544 . . . . 0.0 112.388 179.78 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 192' ' ' CYS . . . . . 0.816 ' O ' HG22 ' A' ' 8' ' ' THR . 0.0 OUTLIER . . . . . 0 CA--C 1.498 -1.036 0 CA-C-O 121.959 0.885 . . . . 0.0 111.467 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 193' ' ' CYS . . . . . 0.704 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.1 OUTLIER 44.67 178.26 0.0 OUTLIER Pre-proline 0 C--N 1.314 -0.972 0 CA-C-N 113.048 -1.887 . . . . 0.0 112.954 173.622 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 194' ' ' PRO . . . . . 0.599 ' O ' HG21 ' A' ' 8' ' ' THR . 95.2 Cg_endo -86.75 -178.62 2.68 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.815 2.343 . . . . 0.0 112.706 -179.469 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -116.09 -69.48 0.85 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.296 -179.858 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 196' ' ' THR . . . . . 0.601 ' C ' ' H ' ' B' ' 198' ' ' TYR . 12.8 t -143.05 40.79 0.34 Allowed Pre-proline 0 C--N 1.33 -0.256 0 N-CA-C 112.376 0.509 . . . . 0.0 112.376 -179.449 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 197' ' ' PRO . . . . . 0.526 ' CD ' ' N ' ' B' ' 196' ' ' THR . 73.8 Cg_endo -74.38 17.79 0.51 Allowed 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 121.52 1.48 . . . . 0.0 108.987 175.953 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 198' ' ' TYR . . . . . 0.601 ' H ' ' C ' ' B' ' 196' ' ' THR . 77.9 t80 . . . . . 0 C--O 1.249 1.079 0 CA-C-N 113.994 -1.457 . . . . 0.0 111.272 -178.915 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 1' ' ' ILE . . . . . 0.749 HG23 ' HA ' ' A' ' 62' ' ' THR . 27.2 mm . . . . . 0 N--CA 1.487 1.375 0 CA-C-O 120.899 0.38 . . . . 0.0 111.09 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 2' ' ' VAL . . . . . 0.612 HG22 ' H ' ' A' ' 3' ' ' CYS . 1.1 p -174.98 178.81 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.033 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.612 ' H ' HG22 ' A' ' 2' ' ' VAL . 0.1 OUTLIER -127.0 92.23 3.49 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 120.636 0.255 . . . . 0.0 111.656 -179.527 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 84.8 m-70 -39.58 147.22 0.08 Allowed 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.902 179.816 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 18.9 p -71.9 79.89 0.9 Allowed 'General case' 0 C--N 1.334 -0.085 0 CA-C-O 120.902 0.382 . . . . 0.0 111.411 -179.467 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.513 ' O ' ' HB3' ' A' ' 7' ' ' ALA . 4.7 p 63.31 7.48 2.91 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.734 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.513 ' HB3' ' O ' ' A' ' 6' ' ' THR . . . 73.83 -55.62 0.66 Allowed 'General case' 0 N--CA 1.462 0.174 0 N-CA-C 111.909 0.336 . . . . 0.0 111.909 179.506 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.424 ' C ' ' O ' ' A' ' 7' ' ' ALA . 33.9 p . . . . . 0 N--CA 1.468 0.455 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 -179.539 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_exo . . . . . 0 CA--C 1.533 0.454 0 N-CA-C 113.144 0.401 . . . . 0.0 113.144 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_exo -46.09 177.79 0.01 OUTLIER 'Trans proline' 0 C--N 1.35 0.608 0 C-N-CA 123.196 2.598 . . . . 0.0 113.33 -179.168 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 69.39 -158.72 53.23 Favored Glycine 0 N--CA 1.451 -0.345 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.981 -179.729 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -57.96 -166.18 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 110.209 -0.293 . . . . 0.0 110.209 179.424 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ASN . . . . . 0.576 ' CB ' ' HB2' ' A' ' 46' ' ' ALA . 0.0 OUTLIER 66.23 90.38 0.09 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.186 0.517 . . . . 0.0 109.724 -179.899 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.553 ' HB3' ' HB3' ' A' ' 60' ' ' CYS . 0.7 OUTLIER -112.52 178.12 4.4 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.315 0.578 . . . . 0.0 112.13 -178.9 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.574 ' O ' ' HB2' ' A' ' 60' ' ' CYS . 12.7 m -62.62 84.94 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.264 -0.88 . . . . 0.0 112.877 -178.278 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.531 ' HB3' ' HA ' ' A' ' 59' ' ' CYS . 40.0 p90 -68.09 70.24 0.15 Allowed 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.507 0.67 . . . . 0.0 109.298 178.153 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.463 ' N ' ' O ' ' A' ' 23' ' ' CYS . 0.0 OUTLIER -41.15 147.1 0.15 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.11 -0.95 . . . . 0.0 112.948 -178.347 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -130.48 171.89 12.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 114.974 -1.012 . . . . 0.0 109.547 179.065 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 2.3 ttp -160.53 -176.55 5.64 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.916 0.389 . . . . 0.0 111.574 -179.776 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' TRP . . . . . 0.431 ' HA ' ' CE3' ' A' ' 28' ' ' TRP . 0.4 OUTLIER -100.3 -164.35 1.11 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.246 -179.948 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER 69.7 -65.37 0.31 Allowed 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.809 -179.935 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 61.97 78.51 0.29 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.25 179.659 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . 48.89 45.01 22.53 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.447 179.631 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -152.23 -170.56 3.68 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.688 179.862 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 44.89 -170.76 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.448 179.822 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 47.7 t -89.58 -28.56 19.48 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.472 179.636 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.461 ' O ' ' N ' ' A' ' 37' ' ' GLY . 1.3 p -179.74 -49.58 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.796 179.814 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 30.87 -87.22 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.329 0.652 . . . . 0.0 112.496 179.614 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.461 ' N ' ' O ' ' A' ' 35' ' ' SER . . . 62.05 -105.76 1.03 Allowed Glycine 0 C--N 1.332 0.347 0 C-N-CA 120.508 -0.853 . . . . 0.0 112.781 179.795 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.487 ' HA ' ' HD2' ' A' ' 38' ' ' LYS . 0.4 OUTLIER . . . . . 0 N--CA 1.455 -0.209 0 CA-C-O 121.174 0.511 . . . . 0.0 111.745 179.944 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' GLY . . . . . 0.479 ' HA2' ' CZ ' ' A' ' 24' ' ' TYR . . . . . . . . 0 N--CA 1.448 -0.542 0 CA-C-O 120.658 0.032 . . . . 0.0 113.108 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.493 ' HA ' ' O ' ' A' ' 22' ' ' LEU . 52.5 t 74.72 88.01 0.09 Allowed 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.998 0.427 . . . . 0.0 110.503 -178.94 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.408 ' CB ' ' CE1' ' A' ' 24' ' ' TYR . . . -164.68 146.37 8.18 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.729 -0.668 . . . . 0.0 111.12 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.576 ' HB2' ' CB ' ' A' ' 21' ' ' ASN . . . -121.64 76.99 1.31 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.089 -179.796 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.797 HG23 ' HD3' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -172.49 -38.82 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.008 -179.888 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.414 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 5.7 m 59.41 52.32 3.78 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.396 179.532 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.797 ' HD3' HG23 ' A' ' 47' ' ' THR . 59.6 Cg_endo -71.97 -9.82 25.22 Favored 'Trans proline' 0 C--N 1.343 0.266 0 C-N-CA 122.315 2.01 . . . . 0.0 111.578 179.004 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 6.8 t -55.51 140.45 40.46 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.143 179.797 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -168.26 33.66 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.678 179.899 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.419 ' HB3' ' HD2' ' A' ' 53' ' ' PRO . 1.4 mttm -81.98 158.48 67.39 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.668 -179.887 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' PRO . . . . . 0.419 ' HD2' ' HB3' ' A' ' 52' ' ' LYS . 12.7 Cg_endo -56.35 -70.48 0.04 OUTLIER 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.527 2.151 . . . . 0.0 112.13 179.93 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' TYR . . . . . 0.406 ' CZ ' ' HG2' ' A' ' 53' ' ' PRO . 0.0 OUTLIER . . . . . 0 N--CA 1.468 0.466 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.132 -179.906 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 3.8 t . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.735 0.302 . . . . 0.0 110.876 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 59' ' ' CYS . . . . . 0.531 ' HA ' ' HB3' ' A' ' 24' ' ' TYR . 1.3 m 62.1 124.09 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.975 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.574 ' HB2' ' O ' ' A' ' 23' ' ' CYS . 4.6 t -84.91 -52.65 5.85 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.103 -179.679 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 53.09 99.62 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.314 179.646 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.749 ' HA ' HG23 ' A' ' 1' ' ' ILE . 46.7 p 40.69 96.66 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.902 179.689 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ASP . . . . . 0.44 ' O ' ' CG ' ' A' ' 64' ' ' LYS . 1.0 OUTLIER 178.26 -13.14 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 179.634 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.473 ' O ' ' C ' ' A' ' 65' ' ' CYS . 3.8 ptmm? 46.65 31.75 1.48 Allowed 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 120.742 0.306 . . . . 0.0 110.839 -179.405 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 65' ' ' CYS . . . . . 0.473 ' C ' ' O ' ' A' ' 64' ' ' LYS . 0.1 OUTLIER -17.0 -65.36 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 115.459 -0.791 . . . . 0.0 112.674 -179.757 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 58.9 t30 76.5 92.21 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.307 -179.848 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' PRO . . . . . 0.423 ' HD2' ' HB2' ' A' ' 7' ' ' ALA . 12.8 Cg_exo -69.4 -171.62 0.46 Allowed 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.759 2.306 . . . . 0.0 112.109 179.83 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 24.6 p-80 176.71 158.57 0.46 Allowed Pre-proline 0 C--N 1.331 -0.224 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.839 179.805 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' PRO . . . . . 0.458 ' HB3' ' CE ' ' A' ' 38' ' ' LYS . 45.1 Cg_exo -55.57 136.35 73.63 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.509 2.139 . . . . 0.0 112.139 179.908 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.424 ' HG2' ' O ' ' A' ' 35' ' ' SER . 0.4 OUTLIER -92.79 -50.62 5.48 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.44 179.812 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.419 ' CB ' ' HG2' ' A' ' 38' ' ' LYS . 42.4 tp60 . . . . . 0 C--O 1.232 0.175 0 CA-C-O 120.846 0.355 . . . . 0.0 111.004 179.763 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 192' ' ' CYS . . . . . 0.697 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.0 OUTLIER . . . . . 0 CA--C 1.497 -1.073 0 CA-C-O 121.884 0.85 . . . . 0.0 111.587 . . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 193' ' ' CYS . . . . . 0.697 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.1 OUTLIER 43.14 81.65 0.24 Allowed Pre-proline 0 N--CA 1.439 -1.003 0 CA-C-N 113.452 -1.704 . . . . 0.0 112.161 173.75 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 194' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -86.44 30.67 0.48 Allowed 'Trans proline' 0 N--CA 1.461 -0.384 0 C-N-CA 123.054 2.503 . . . . 0.0 112.781 -179.878 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -162.45 71.57 0.32 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.876 0.369 . . . . 0.0 110.664 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 196' ' ' THR . . . . . 0.657 ' N ' ' HD3' ' B' ' 197' ' ' PRO . 65.2 p -143.36 47.93 0.88 Allowed Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.871 -179.875 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 197' ' ' PRO . . . . . 0.657 ' HD3' ' N ' ' B' ' 196' ' ' THR . 6.3 Cg_exo -73.95 13.5 0.8 Allowed 'Trans proline' 0 C--N 1.351 0.683 0 C-N-CA 121.674 1.583 . . . . 0.0 108.742 175.941 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 198' ' ' TYR . . . . . 0.596 ' H ' ' C ' ' B' ' 196' ' ' THR . 63.9 t80 . . . . . 0 C--O 1.249 1.049 0 CA-C-N 113.929 -1.487 . . . . 0.0 111.291 -178.803 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 1' ' ' ILE . . . . . 0.539 HG23 ' H ' ' A' ' 2' ' ' VAL . 2.1 tp . . . . . 0 N--CA 1.486 1.37 0 CA-C-O 120.593 0.235 . . . . 0.0 111.1 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 2' ' ' VAL . . . . . 0.634 HG13 ' N ' ' A' ' 3' ' ' CYS . 0.5 OUTLIER -178.97 -169.04 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.566 -0.288 . . . . 0.0 110.792 -179.933 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.634 ' N ' HG13 ' A' ' 2' ' ' VAL . 0.9 OUTLIER -147.16 -50.26 0.19 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.712 0.291 . . . . 0.0 111.302 179.971 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 4' ' ' HIS . . . . . 0.45 ' CE1' ' HA ' ' A' ' 64' ' ' LYS . 6.7 p-80 53.95 110.28 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.244 0.545 . . . . 0.0 111.029 -179.591 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.9 t -82.7 109.95 17.33 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.552 -179.029 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.413 ' CG2' ' HB3' ' B' ' 194' ' ' PRO . 4.0 m -93.55 17.77 11.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.356 179.659 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -59.76 84.78 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.785 0.326 . . . . 0.0 110.93 179.919 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 2.2 p . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.896 -179.711 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.613 ' N ' ' HD2' ' A' ' 18' ' ' PRO . 74.2 Cg_exo . . . . . 0 CA--C 1.531 0.355 0 N-CA-C 112.981 0.339 . . . . 0.0 112.981 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.613 ' HD2' ' N ' ' A' ' 17' ' ' PRO . 11.2 Cg_endo -55.37 -62.14 0.3 Allowed 'Trans proline' 0 C--N 1.349 0.575 0 C-N-CA 122.345 2.03 . . . . 0.0 112.498 -179.649 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.497 ' HA2' ' HA ' ' A' ' 46' ' ' ALA . . . -45.99 156.7 0.45 Allowed Glycine 0 C--N 1.331 0.25 0 C-N-CA 120.823 -0.703 . . . . 0.0 112.459 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.916 ' HG3' HD11 ' A' ' 22' ' ' LEU . 0.0 OUTLIER -99.4 48.96 0.94 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.031 0.444 . . . . 0.0 112.128 -179.314 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ASN . . . . . 0.547 ' C ' HD13 ' A' ' 22' ' ' LEU . 0.3 OUTLIER 77.72 60.52 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.744 -0.662 . . . . 0.0 112.441 178.357 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.916 HD11 ' HG3' ' A' ' 20' ' ' GLU . 0.0 OUTLIER -152.13 96.7 2.22 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 121.003 0.43 . . . . 0.0 111.605 178.366 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.562 ' HA ' ' HA ' ' A' ' 44' ' ' CYS . 9.5 m -87.77 44.81 1.22 Allowed 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.825 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.605 ' O ' ' CB ' ' A' ' 25' ' ' ARG . 0.2 OUTLIER 35.29 -89.31 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 179.535 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.605 ' CB ' ' O ' ' A' ' 24' ' ' TYR . 12.5 ttm-85 107.08 -59.69 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.331 0.652 . . . . 0.0 111.835 -179.959 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 61.53 123.89 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.541 -179.048 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 10.0 ptt? -144.41 137.59 27.13 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.003 0.43 . . . . 0.0 111.87 -179.65 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 4.3 t90 -136.41 142.54 43.69 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.426 179.399 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' CYS . . . . . 0.476 ' HA ' ' CB ' ' A' ' 33' ' ' CYS . 33.8 t 69.94 11.13 7.67 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.51 -179.822 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -97.97 44.82 1.03 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.778 0.323 . . . . 0.0 111.072 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -178.3 -88.32 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.983 179.753 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -96.63 76.47 2.85 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.996 0.427 . . . . 0.0 110.077 179.526 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.476 ' CB ' ' HA ' ' A' ' 29' ' ' CYS . 7.2 t -161.15 156.49 24.43 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.798 -179.119 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -51.35 -54.3 27.73 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.96 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 2.6 m -86.43 168.29 13.91 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.614 179.755 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.419 ' CG ' ' O ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -100.51 63.12 1.08 Allowed 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.363 -179.637 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.446 ' N ' ' O ' ' A' ' 29' ' ' CYS . . . 78.46 144.26 2.47 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.436 -0.887 . . . . 0.0 113.118 179.498 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.59 ' HA ' ' HG2' ' A' ' 70' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.308 0 CA-C-O 121.333 0.587 . . . . 0.0 109.83 179.574 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.52 0.345 0 CA-C-O 119.921 -0.377 . . . . 0.0 113.74 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.562 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 52.5 t 61.32 152.88 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 117.602 0.701 . . . . 0.0 111.496 179.752 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.574 ' O ' ' HB2' ' A' ' 46' ' ' ALA . . . -128.06 -79.37 0.58 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.743 179.745 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.575 ' CA ' HD21 ' A' ' 22' ' ' LEU . . . 168.01 -24.98 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.874 179.699 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 14.8 t -146.1 134.19 21.55 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.766 0.317 . . . . 0.0 111.438 -179.449 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.489 ' O ' ' N ' ' A' ' 50' ' ' SER . 11.3 m -78.99 -47.11 1.69 Allowed Pre-proline 0 C--N 1.333 -0.142 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.732 179.552 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.486 ' HD3' ' HB2' ' A' ' 48' ' ' CYS . 17.3 Cg_exo -65.97 59.76 0.44 Allowed 'Trans proline' 0 C--N 1.349 0.585 0 C-N-CA 122.335 2.024 . . . . 0.0 110.374 178.701 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.489 ' N ' ' O ' ' A' ' 48' ' ' CYS . 23.0 t -93.65 -41.23 9.83 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 115.231 -0.895 . . . . 0.0 111.018 -178.615 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.528 ' O ' ' CB ' ' A' ' 52' ' ' LYS . 4.3 mmtm -141.47 -80.12 0.25 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.712 179.747 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.71 ' HB2' ' HD3' ' A' ' 53' ' ' PRO . 4.9 mtpp 107.29 -56.92 0.0 OUTLIER Pre-proline 0 N--CA 1.474 0.759 0 C-N-CA 123.954 0.902 . . . . 0.0 111.355 179.735 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' PRO . . . . . 0.71 ' HD3' ' HB2' ' A' ' 52' ' ' LYS . 39.4 Cg_exo -59.83 -156.65 0.02 OUTLIER 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 122.06 1.84 . . . . 0.0 111.971 179.641 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.468 0.474 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.598 179.691 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.456 -0.143 0 CA-C-O 120.916 0.389 . . . . 0.0 110.441 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 2.7 m 68.99 168.04 0.28 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.581 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.499 ' HB3' ' HB2' ' A' ' 23' ' ' CYS . 0.1 OUTLIER -162.18 36.14 0.12 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.742 0.306 . . . . 0.0 111.495 -179.374 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.549 ' C ' HG23 ' A' ' 62' ' ' THR . 0.1 OUTLIER -74.72 -163.0 0.18 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.655 0.264 . . . . 0.0 111.222 -179.916 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.549 HG23 ' C ' ' A' ' 61' ' ' SER . 1.4 p 77.71 27.99 0.58 Allowed 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.224 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 16.2 t70 60.68 149.66 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.572 179.288 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.45 ' HA ' ' CE1' ' A' ' 4' ' ' HIS . 0.0 OUTLIER 29.53 87.39 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 115.631 -0.713 . . . . 0.0 112.517 179.57 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 65' ' ' CYS . . . . . 0.432 ' CB ' ' O ' ' A' ' 60' ' ' CYS . 49.0 t -123.4 -10.49 7.97 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.297 179.77 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.54 ' N ' ' HD2' ' A' ' 67' ' ' PRO . 9.9 m120 -63.07 -57.06 22.87 Favored Pre-proline 0 CA--C 1.531 0.236 0 CA-C-N 116.578 -0.283 . . . . 0.0 111.534 -179.913 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 67' ' ' PRO . . . . . 0.54 ' HD2' ' N ' ' A' ' 66' ' ' ASN . 1.3 Cg_endo -42.83 165.4 0.03 OUTLIER 'Trans proline' 0 C--N 1.349 0.58 0 C-N-CA 122.992 2.461 . . . . 0.0 112.94 -179.65 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.52 ' N ' ' HD3' ' A' ' 69' ' ' PRO . 2.2 m-70 57.57 51.81 5.08 Favored Pre-proline 0 C--N 1.331 -0.197 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.064 -179.801 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' PRO . . . . . 0.52 ' HD3' ' N ' ' A' ' 68' ' ' HIS . 96.6 Cg_endo -86.63 -47.6 0.04 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.595 0 C-N-CA 122.479 2.12 . . . . 0.0 113.105 -179.697 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.59 ' HG2' ' HA ' ' A' ' 38' ' ' LYS . 0.0 OUTLIER -179.01 -164.12 0.07 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.662 -179.051 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.53 0.205 0 N-CA-C 111.7 0.259 . . . . 0.0 111.7 179.441 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 192' ' ' CYS . . . . . 0.697 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.0 OUTLIER . . . . . 0 CA--C 1.498 -1.029 0 CA-C-O 121.752 0.787 . . . . 0.0 110.985 . . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 193' ' ' CYS . . . . . 0.697 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.1 OUTLIER 41.31 73.36 0.9 Allowed Pre-proline 0 C--N 1.314 -0.946 0 CA-C-N 113.625 -1.625 . . . . 0.0 112.172 173.706 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 194' ' ' PRO . . . . . 0.413 ' HB3' ' CG2' ' A' ' 6' ' ' THR . 36.2 Cg_endo -65.06 -87.42 0.0 OUTLIER 'Trans proline' 0 CA--C 1.531 0.331 0 C-N-CA 122.555 2.17 . . . . 0.0 112.391 -179.749 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 30.9 t0 -106.14 13.64 28.74 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.566 0.222 . . . . 0.0 111.539 -179.805 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 196' ' ' THR . . . . . 0.762 ' C ' ' H ' ' B' ' 198' ' ' TYR . 77.3 p -79.89 -22.32 0.36 Allowed Pre-proline 0 C--N 1.331 -0.208 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 179.951 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 197' ' ' PRO . . . . . 0.664 ' CD ' ' N ' ' B' ' 196' ' ' THR . 17.2 Cg_exo -64.73 27.87 0.08 OUTLIER 'Trans proline' 0 C--N 1.355 0.878 0 C-N-CA 121.329 1.353 . . . . 0.0 109.622 177.172 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 198' ' ' TYR . . . . . 0.762 ' H ' ' C ' ' B' ' 196' ' ' THR . 13.0 t80 . . . . . 0 C--O 1.249 1.026 0 CA-C-N 114.283 -1.326 . . . . 0.0 111.28 -178.739 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 1' ' ' ILE . . . . . 0.534 HG21 ' C ' ' A' ' 62' ' ' THR . 1.2 mm . . . . . 0 N--CA 1.487 1.419 0 CA-C-O 120.758 0.313 . . . . 0.0 110.781 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -96.41 146.95 6.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.921 -179.818 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 29.2 p -127.0 116.45 20.78 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 112.37 0.507 . . . . 0.0 112.37 -178.68 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -46.35 166.3 0.02 OUTLIER 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.278 179.163 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 21.2 p -88.91 126.09 35.23 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.924 -179.843 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -121.04 28.82 7.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.069 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -48.26 -30.36 4.71 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 121.018 0.437 . . . . 0.0 111.046 179.797 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 88.0 m . . . . . 0 C--N 1.328 -0.359 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.239 179.702 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.448 ' HB3' ' O ' ' A' ' 21' ' ' ASN . 69.3 Cg_endo . . . . . 0 N--CA 1.456 -0.721 0 N-CA-C 113.723 0.624 . . . . 0.0 113.723 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.433 ' O ' ' N ' ' A' ' 20' ' ' GLU . 49.3 Cg_endo -68.56 162.86 39.1 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.013 1.809 . . . . 0.0 111.106 178.808 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 53.26 -88.45 0.01 OUTLIER Glycine 0 CA--C 1.519 0.295 0 C-N-CA 120.528 -0.844 . . . . 0.0 112.518 -179.866 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.433 ' N ' ' O ' ' A' ' 18' ' ' PRO . 14.5 mt-10 -140.07 111.82 7.41 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.807 0.337 . . . . 0.0 110.884 179.842 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ASN . . . . . 0.493 ' O ' ' C ' ' A' ' 22' ' ' LEU . 0.3 OUTLIER -178.5 34.09 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.081 179.904 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.789 HD23 ' O ' ' A' ' 47' ' ' THR . 0.2 OUTLIER -12.85 124.94 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 -179.822 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.581 ' O ' ' N ' ' A' ' 44' ' ' CYS . 0.1 OUTLIER -43.65 -29.41 0.5 Allowed 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.898 -179.691 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.509 ' CD2' ' HB2' ' A' ' 45' ' ' ALA . 0.2 OUTLIER 60.58 126.4 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.997 0.427 . . . . 0.0 111.344 179.51 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 3.0 ttt180 -117.21 78.06 1.18 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.801 179.75 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 2.9 mtmm -64.67 154.55 36.2 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.13 -179.83 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 1.8 ttm -157.5 100.45 1.8 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.52 179.862 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -56.42 -36.74 69.3 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.476 -179.544 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER 59.63 -168.4 0.15 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.826 0.346 . . . . 0.0 110.72 179.914 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 26.7 p-10 -91.71 -38.3 12.49 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.816 179.847 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -171.93 -56.08 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.809 179.855 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -131.96 17.48 4.64 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.974 179.58 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 93.0 m 56.84 165.76 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.945 0.402 . . . . 0.0 111.337 179.755 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 11.4 p 172.13 -34.16 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.499 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -161.36 -43.74 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.584 179.937 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.53 -172.22 1.75 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.967 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.411 ' O ' ' C ' ' A' ' 38' ' ' LYS . . . 169.69 -38.62 0.2 Allowed Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 121.141 -0.552 . . . . 0.0 111.887 -179.844 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.634 ' HA ' ' HB2' ' A' ' 70' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.467 0.387 0 N-CA-C 113.534 0.938 . . . . 0.0 113.534 179.673 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.195 0 N-CA-C 113.241 0.056 . . . . 0.0 113.241 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.581 ' N ' ' O ' ' A' ' 23' ' ' CYS . 13.7 m 60.61 152.56 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.075 0.464 . . . . 0.0 111.659 179.045 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.525 ' O ' ' HB2' ' A' ' 46' ' ' ALA . . . -133.0 -77.97 0.49 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.997 179.96 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.525 ' HB2' ' O ' ' A' ' 45' ' ' ALA . . . 170.75 -31.26 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.347 179.924 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.789 ' O ' HD23 ' A' ' 22' ' ' LEU . 13.5 t -141.35 -165.55 1.99 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.345 -179.686 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.547 ' H ' ' HD2' ' A' ' 49' ' ' PRO . 34.5 t -148.03 -60.46 0.02 OUTLIER Pre-proline 0 C--N 1.331 -0.205 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.494 -179.993 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.547 ' HD2' ' H ' ' A' ' 48' ' ' CYS . 3.4 Cg_exo -39.66 -26.83 0.17 Allowed 'Trans proline' 0 C--N 1.353 0.77 0 C-N-CA 122.519 2.146 . . . . 0.0 111.52 179.083 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.477 ' HB2' HG23 ' A' ' 47' ' ' THR . 0.9 OUTLIER -41.47 136.05 1.89 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.42 178.708 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 170.63 59.81 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.915 0.388 . . . . 0.0 111.043 179.62 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.525 ' HB2' ' HD3' ' A' ' 53' ' ' PRO . 0.0 OUTLIER -97.14 -67.07 0.07 OUTLIER Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.101 179.878 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 53' ' ' PRO . . . . . 0.525 ' HD3' ' HB2' ' A' ' 52' ' ' LYS . 72.2 Cg_endo -76.14 166.52 27.66 Favored 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 122.132 1.888 . . . . 0.0 112.286 179.907 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.469 0.49 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.935 179.998 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.529 0.168 0 CA-C-O 120.771 0.319 . . . . 0.0 111.075 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 7.8 t 49.61 97.47 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.719 179.674 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.407 ' HB3' ' HB3' ' A' ' 23' ' ' CYS . 21.1 t -84.71 -108.71 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 179.162 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.67 ' CB ' HD12 ' A' ' 22' ' ' LEU . 2.8 p 69.62 -59.22 0.5 Allowed 'General case' 0 N--CA 1.463 0.191 0 N-CA-C 111.955 0.354 . . . . 0.0 111.955 179.187 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.534 ' C ' HG21 ' A' ' 1' ' ' ILE . 23.8 p -51.56 -173.55 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.938 0.399 . . . . 0.0 111.6 -179.403 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' ASP . . . . . 0.468 ' N ' HG21 ' A' ' 1' ' ' ILE . 2.0 p30 -39.88 160.1 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.754 -179.56 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 29.6 mtpt -40.73 92.49 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.484 -179.619 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' CYS . . . . . 0.438 ' N ' ' O ' ' A' ' 63' ' ' ASP . 4.1 m -38.75 -40.78 0.65 Allowed 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.247 -179.914 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 2.2 m120 43.23 55.29 11.21 Favored Pre-proline 0 N--CA 1.463 0.196 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.577 179.621 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -71.6 -8.32 22.97 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.424 2.083 . . . . 0.0 112.532 179.935 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 21.7 m170 60.19 158.83 0.11 Allowed Pre-proline 0 C--N 1.332 -0.189 0 CA-C-N 116.53 -0.304 . . . . 0.0 110.591 -179.835 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' PRO . . . . . 0.489 ' HG2' ' HA ' ' B' ' 194' ' ' PRO . 67.1 Cg_exo -43.65 -66.43 0.16 Allowed 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.601 2.201 . . . . 0.0 113.106 -179.45 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.634 ' HB2' ' HA ' ' A' ' 38' ' ' LYS . 0.0 OUTLIER -134.73 178.91 6.64 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 120.645 0.26 . . . . 0.0 110.939 -179.408 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.467 ' N ' ' HG2' ' A' ' 70' ' ' LYS . 14.5 tp60 . . . . . 0 N--CA 1.463 0.218 0 N-CA-C 111.915 0.339 . . . . 0.0 111.915 -179.597 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 192' ' ' CYS . . . . . 0.724 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.2 OUTLIER . . . . . 0 CA--C 1.502 -0.871 0 CA-C-O 121.652 0.739 . . . . 0.0 112.431 . . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 193' ' ' CYS . . . . . 0.724 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.0 OUTLIER -157.45 170.98 8.06 Favored Pre-proline 0 N--CA 1.438 -1.027 0 CA-C-N 114.055 -1.43 . . . . 0.0 111.737 -173.209 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 194' ' ' PRO . . . . . 0.489 ' HA ' ' HG2' ' A' ' 69' ' ' PRO . 1.5 Cg_endo -44.36 -70.85 0.06 OUTLIER 'Trans proline' 0 C--N 1.35 0.658 0 C-N-CA 123.149 2.566 . . . . 0.0 112.807 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -144.37 -85.73 0.13 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.004 -179.682 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 196' ' ' THR . . . . . 0.594 ' C ' ' H ' ' B' ' 198' ' ' TYR . 0.2 OUTLIER -157.06 43.53 0.18 Allowed Pre-proline 0 C--N 1.332 -0.185 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.817 -179.722 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 197' ' ' PRO . . . . . 0.491 ' CD ' ' N ' ' B' ' 196' ' ' THR . 72.7 Cg_endo -74.13 17.18 0.52 Allowed 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 121.627 1.551 . . . . 0.0 109.016 176.203 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 198' ' ' TYR . . . . . 0.594 ' H ' ' C ' ' B' ' 196' ' ' THR . 29.6 t80 . . . . . 0 C--O 1.249 1.064 0 CA-C-N 113.875 -1.512 . . . . 0.0 111.357 -178.781 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 1' ' ' ILE . . . . . 0.913 HG22 HD11 ' A' ' 22' ' ' LEU . 1.3 tp . . . . . 0 N--CA 1.487 1.407 0 CA-C-O 120.508 0.194 . . . . 0.0 111.079 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 2' ' ' VAL . . . . . 0.686 HG12 HG13 ' A' ' 1' ' ' ILE . 9.9 p 177.08 147.0 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.517 -0.31 . . . . 0.0 110.847 179.902 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -154.9 131.1 10.31 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.77 0.319 . . . . 0.0 111.265 -179.847 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 59.2 m-70 -48.69 171.75 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.944 179.712 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -75.58 -167.46 0.68 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.661 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.607 ' O ' ' HB3' ' A' ' 7' ' ' ALA . 9.6 t -46.07 -25.05 0.51 Allowed 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.364 179.819 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.607 ' HB3' ' O ' ' A' ' 6' ' ' THR . . . 83.36 78.89 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.534 179.71 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.2 179.234 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.442 ' N ' ' CD ' ' A' ' 18' ' ' PRO . 28.4 Cg_exo . . . . . 0 CA--C 1.53 0.28 0 N-CA-C 112.562 0.178 . . . . 0.0 112.562 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.442 ' CD ' ' N ' ' A' ' 17' ' ' PRO . 41.5 Cg_exo -56.74 175.1 0.32 Allowed 'Trans proline' 0 C--N 1.347 0.492 0 C-N-CA 122.394 2.063 . . . . 0.0 112.351 179.935 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 55.47 -166.69 3.2 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.872 -0.68 . . . . 0.0 112.819 179.756 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.785 ' N ' ' HB2' ' A' ' 46' ' ' ALA . 1.6 tt0 -159.8 22.93 0.18 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.636 0.255 . . . . 0.0 111.064 179.869 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ASN . . . . . 0.482 ' N ' ' O ' ' A' ' 45' ' ' ALA . 4.8 m120 -137.02 10.0 3.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.318 179.612 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.913 HD11 HG22 ' A' ' 1' ' ' ILE . 0.0 OUTLIER 70.11 -172.18 0.17 Allowed 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 112.846 0.684 . . . . 0.0 112.846 178.841 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.553 ' HA ' ' HA ' ' A' ' 44' ' ' CYS . 56.3 m -59.88 175.61 0.37 Allowed 'General case' 0 N--CA 1.46 0.048 0 CA-C-N 114.863 -1.062 . . . . 0.0 112.002 -179.738 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.603 ' CZ ' ' HB3' ' A' ' 45' ' ' ALA . 4.3 m-30 -119.17 -54.52 2.2 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.42 179.476 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.437 ' CG ' ' O ' ' A' ' 24' ' ' TYR . 0.0 OUTLIER 78.18 170.98 0.2 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.967 -179.041 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 177.95 74.93 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.447 -179.523 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 22.7 mtp -81.86 -176.37 6.07 Favored 'General case' 0 C--N 1.321 -0.644 0 C-N-CA 120.459 -0.496 . . . . 0.0 111.169 -179.416 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' TRP . . . . . 0.473 ' HA ' ' CE3' ' A' ' 28' ' ' TRP . 0.0 OUTLIER -133.38 86.93 2.34 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.503 179.885 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 29' ' ' CYS . . . . . 0.448 ' HA ' ' HG2' ' A' ' 36' ' ' ARG . 0.1 OUTLIER -148.34 66.29 1.08 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.587 -179.74 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.428 ' HB2' ' CZ3' ' A' ' 28' ' ' TRP . 1.2 t0 -52.08 90.51 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.845 -179.275 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . 38.9 -90.54 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.008 -0.542 . . . . 0.0 112.208 179.434 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.426 ' N ' ' O ' ' A' ' 30' ' ' ASP . 0.2 OUTLIER -64.07 79.7 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.983 0.42 . . . . 0.0 110.758 179.998 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 66.1 m -71.04 -73.44 0.17 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.909 -179.864 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.8 m 69.04 -64.8 0.31 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.918 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 45.7 m -137.55 53.89 1.84 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.974 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.448 ' HG2' ' HA ' ' A' ' 29' ' ' CYS . 2.1 tpt180 -100.29 -149.8 0.37 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.76 179.864 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -159.92 144.4 10.06 Favored Glycine 0 C--N 1.334 0.418 0 C-N-CA 120.294 -0.955 . . . . 0.0 112.844 -179.68 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.546 ' HB2' ' CB ' ' A' ' 70' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.296 0 CA-C-O 121.135 0.493 . . . . 0.0 111.36 -179.759 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' GLY . . . . . 0.414 ' HA3' ' HB2' ' A' ' 24' ' ' TYR . . . . . . . . 0 N--CA 1.45 -0.371 0 N-CA-C 112.468 -0.253 . . . . 0.0 112.468 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.553 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 10.8 t 66.24 117.0 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.609 0.242 . . . . 0.0 110.814 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.603 ' HB3' ' CZ ' ' A' ' 24' ' ' TYR . . . -164.51 -170.32 2.0 Favored 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 120.618 -0.433 . . . . 0.0 111.83 -179.976 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.785 ' HB2' ' N ' ' A' ' 20' ' ' GLU . . . -132.17 34.55 3.78 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.215 -179.851 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.457 ' O ' HG22 ' A' ' 47' ' ' THR . 2.5 m -171.93 94.92 0.15 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.576 -179.691 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.48 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 1.8 t -147.24 46.06 0.47 Allowed Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.987 179.909 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.48 ' CD ' ' N ' ' A' ' 48' ' ' CYS . 87.0 Cg_endo -79.11 -5.38 14.43 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.396 2.064 . . . . 0.0 111.447 178.613 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 6.3 t -65.74 163.73 15.99 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.318 -179.703 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.559 ' O ' ' CB ' ' A' ' 52' ' ' LYS . 0.5 OUTLIER 172.36 175.35 0.09 Allowed 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.828 179.669 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.559 ' CB ' ' O ' ' A' ' 51' ' ' LYS . 4.8 mtpm? 115.79 -48.32 0.0 OUTLIER Pre-proline 0 N--CA 1.475 0.824 0 C-N-CA 124.171 0.989 . . . . 0.0 111.425 179.84 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' PRO . . . . . 0.504 ' HD3' ' HB2' ' A' ' 52' ' ' LYS . 24.9 Cg_exo -62.28 139.61 78.46 Favored 'Trans proline' 0 C--N 1.349 0.575 0 C-N-CA 122.131 1.887 . . . . 0.0 111.994 179.893 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.469 0.485 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.865 -179.894 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 4.1 p . . . . . 0 CA--C 1.53 0.18 0 N-CA-C 111.614 0.228 . . . . 0.0 111.614 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 3.9 m 58.33 150.41 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.143 0 CA-C-O 121.011 0.434 . . . . 0.0 110.937 179.62 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.423 ' O ' ' O ' ' A' ' 21' ' ' ASN . 0.1 OUTLIER -122.26 138.18 54.59 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.08 -179.217 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.459 ' HA ' ' CB ' ' A' ' 22' ' ' LEU . 54.2 p -176.8 89.26 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.023 0.439 . . . . 0.0 111.062 179.572 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.451 HG22 ' C ' ' A' ' 61' ' ' SER . 0.6 OUTLIER 164.24 73.23 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.027 179.939 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 63' ' ' ASP . . . . . 0.445 ' H ' HG21 ' A' ' 1' ' ' ILE . 0.6 OUTLIER 63.64 178.39 0.16 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.283 -179.38 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.487 ' CG ' ' O ' ' A' ' 64' ' ' LYS . 0.0 OUTLIER -52.75 90.57 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.406 0.622 . . . . 0.0 110.921 -179.912 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 65' ' ' CYS . . . . . 0.41 ' N ' ' O ' ' A' ' 63' ' ' ASP . 8.0 p -101.13 -11.48 19.55 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.63 -179.463 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 11.9 t-20 -52.96 126.59 43.25 Favored Pre-proline 0 C--N 1.328 -0.36 0 C-N-CA 121.019 -0.272 . . . . 0.0 111.101 -179.229 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -74.04 119.39 5.82 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.526 2.151 . . . . 0.0 112.639 -179.872 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.539 ' HB3' ' HD2' ' A' ' 69' ' ' PRO . 1.7 m80 -69.83 178.51 1.0 Allowed Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.156 -0.474 . . . . 0.0 109.724 179.355 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' PRO . . . . . 0.539 ' HD2' ' HB3' ' A' ' 68' ' ' HIS . 69.8 Cg_exo -43.17 148.16 0.65 Allowed 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.438 2.092 . . . . 0.0 112.515 -179.979 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.546 ' CB ' ' HB2' ' A' ' 38' ' ' LYS . 0.0 OUTLIER -46.16 135.45 7.71 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.035 0.445 . . . . 0.0 111.257 -179.305 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 . . . . . 0 C--N 1.328 -0.346 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.551 -178.985 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 192' ' ' CYS . . . . . 0.704 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.0 OUTLIER . . . . . 0 CA--C 1.501 -0.932 0 N-CA-C 112.774 0.657 . . . . 0.0 112.774 . . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 193' ' ' CYS . . . . . 0.704 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.0 OUTLIER -162.63 155.61 16.8 Favored Pre-proline 0 N--CA 1.439 -1.006 0 CA-C-N 114.736 -1.12 . . . . 0.0 112.15 -172.986 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 194' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -98.02 137.58 0.4 Allowed 'Trans proline' 0 N--CA 1.455 -0.778 0 C-N-CA 123.384 2.723 . . . . 0.0 112.981 -179.646 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 67.97 129.77 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 121.114 0.483 . . . . 0.0 111.767 179.044 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 196' ' ' THR . . . . . 0.601 ' O ' HG22 ' B' ' 196' ' ' THR . 52.0 m -160.11 44.48 0.17 Allowed Pre-proline 0 C--N 1.331 -0.235 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.304 179.645 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 197' ' ' PRO . . . . . 0.508 ' CD ' ' N ' ' B' ' 196' ' ' THR . 80.9 Cg_endo -74.93 14.31 0.87 Allowed 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 121.745 1.63 . . . . 0.0 108.919 176.234 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 198' ' ' TYR . . . . . 0.568 ' H ' ' C ' ' B' ' 196' ' ' THR . 59.3 t80 . . . . . 0 C--O 1.248 1.022 0 CA-C-N 113.896 -1.502 . . . . 0.0 111.299 -178.84 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 1' ' ' ILE . . . . . 0.583 ' CG2' ' C ' ' A' ' 62' ' ' THR . 9.7 mm . . . . . 0 N--CA 1.487 1.406 0 CA-C-O 120.817 0.342 . . . . 0.0 111.156 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 2' ' ' VAL . . . . . 0.465 HG23 ' O ' ' A' ' 1' ' ' ILE . 0.0 OUTLIER 45.01 -171.64 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 CA-C-N 116.155 -0.475 . . . . 0.0 112.231 179.461 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.442 ' O ' ' O ' ' A' ' 4' ' ' HIS . 1.0 OUTLIER -148.09 125.73 11.79 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 116.554 -0.294 . . . . 0.0 110.81 -178.827 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 4' ' ' HIS . . . . . 0.531 ' CG ' ' HB3' ' A' ' 66' ' ' ASN . 4.2 m-70 -37.83 162.95 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 112.073 0.397 . . . . 0.0 112.073 -179.809 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.438 ' OG1' HG23 ' A' ' 6' ' ' THR . 0.2 OUTLIER -137.85 163.36 31.62 Favored 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 112.452 0.538 . . . . 0.0 112.452 -178.354 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.571 ' O ' ' HB3' ' A' ' 7' ' ' ALA . 8.4 p 67.23 -43.34 0.45 Allowed 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 115.378 -0.828 . . . . 0.0 111.674 -179.749 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.571 ' HB3' ' O ' ' A' ' 6' ' ' THR . . . 77.07 -179.76 0.14 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.725 0.298 . . . . 0.0 110.782 -179.678 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.429 ' O ' HG22 ' A' ' 8' ' ' THR . 9.3 m . . . . . 0 C--N 1.332 -0.178 0 CA-C-N 116.466 -0.333 . . . . 0.0 110.552 -179.453 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.474 ' N ' ' CD ' ' A' ' 18' ' ' PRO . 31.2 Cg_exo . . . . . 0 CA--C 1.53 0.324 0 N-CA-C 112.743 0.247 . . . . 0.0 112.743 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.474 ' CD ' ' N ' ' A' ' 17' ' ' PRO . 81.0 Cg_exo -47.56 -63.75 0.3 Allowed 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 122.535 2.157 . . . . 0.0 112.527 -179.891 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -99.43 146.84 18.14 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.186 179.805 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -138.41 29.43 2.43 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.614 0.245 . . . . 0.0 111.199 -179.742 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -141.02 85.39 1.98 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.222 -179.934 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.703 HD12 ' N ' ' A' ' 48' ' ' CYS . 1.4 mt 62.62 123.5 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.574 -0.284 . . . . 0.0 111.537 178.952 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.599 ' HA ' ' HA ' ' A' ' 44' ' ' CYS . 3.8 m -71.8 157.84 37.17 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-O 120.973 0.416 . . . . 0.0 110.788 179.861 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.666 ' HA ' ' HB2' ' A' ' 45' ' ' ALA . 0.8 OUTLIER -65.31 65.3 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.778 -0.646 . . . . 0.0 112.012 -178.97 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.401 ' N ' ' O ' ' A' ' 23' ' ' CYS . 1.1 ttt85 -57.58 82.16 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.906 0.384 . . . . 0.0 110.45 179.215 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.486 ' N ' ' O ' ' A' ' 24' ' ' TYR . 32.8 tttt -85.18 156.59 20.94 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.383 -179.231 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -177.34 100.84 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.764 179.708 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 34.4 t-105 -56.86 -75.27 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.776 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 1.1 m 49.83 81.09 0.06 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.4 179.257 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -62.5 99.38 0.14 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.713 179.737 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . 63.76 -79.55 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.974 -179.75 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -97.32 138.56 34.59 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.601 179.664 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 22.7 m -84.93 -79.08 0.23 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.069 -179.788 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 38.7 t 64.99 -74.76 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.936 -179.904 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.413 ' HA ' ' HE2' ' A' ' 70' ' ' LYS . 1.0 OUTLIER 179.65 29.68 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.09 179.809 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -119.28 -3.16 10.55 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.528 -179.803 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -124.17 54.76 0.72 Allowed Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.57 -0.824 . . . . 0.0 113.307 -179.23 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.469 ' HG2' ' HG3' ' A' ' 70' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 116.719 0.26 . . . . 0.0 111.192 179.625 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' GLY . . . . . 0.481 ' O ' ' HB2' ' A' ' 44' ' ' CYS . . . . . . . . 0 CA--C 1.521 0.459 0 CA-C-O 120.174 -0.237 . . . . 0.0 113.542 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.599 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 1.7 m 70.77 118.28 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 112.635 0.606 . . . . 0.0 112.635 179.034 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.666 ' HB2' ' HA ' ' A' ' 24' ' ' TYR . . . -122.48 174.29 7.14 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.537 179.614 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.891 ' O ' HG22 ' A' ' 47' ' ' THR . . . -101.76 78.71 1.85 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.479 179.77 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.891 HG22 ' O ' ' A' ' 46' ' ' ALA . 3.5 t 61.79 173.26 0.12 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.637 -0.71 . . . . 0.0 111.507 -179.727 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.703 ' N ' HD12 ' A' ' 22' ' ' LEU . 6.0 m -69.74 -50.77 17.06 Favored Pre-proline 0 C--N 1.331 -0.224 0 CA-C-N 116.089 -0.505 . . . . 0.0 112.287 -179.031 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.609 ' HD2' HG23 ' A' ' 47' ' ' THR . 42.3 Cg_exo -34.1 80.82 0.0 OUTLIER 'Trans proline' 0 C--N 1.353 0.787 0 C-N-CA 122.663 2.242 . . . . 0.0 111.622 179.838 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.676 ' N ' ' O ' ' A' ' 48' ' ' CYS . 3.6 t -161.26 -34.77 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.12 -0.945 . . . . 0.0 111.208 -177.571 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.626 ' CG ' HG22 ' A' ' 58' ' ' THR . 0.1 OUTLIER -43.08 -55.85 3.66 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.83 -179.492 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.454 ' CB ' ' CD ' ' A' ' 53' ' ' PRO . 0.0 OUTLIER -45.99 -65.68 0.63 Allowed Pre-proline 0 C--N 1.331 -0.21 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.074 -179.75 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 53' ' ' PRO . . . . . 0.454 ' CD ' ' CB ' ' A' ' 52' ' ' LYS . 32.7 Cg_endo -64.58 -154.12 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.088 1.858 . . . . 0.0 110.965 178.916 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.473 0.694 0 CA-C-O 120.954 0.406 . . . . 0.0 110.843 179.671 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.626 HG22 ' CG ' ' A' ' 51' ' ' LYS . 53.0 p . . . . . 0 N--CA 1.465 0.283 0 N-CA-C 112.711 0.634 . . . . 0.0 112.711 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' CYS . . . . . 0.457 ' HB2' ' HB3' ' A' ' 22' ' ' LEU . 0.8 OUTLIER -179.78 155.94 0.66 Allowed 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.4 -179.373 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.519 ' CB ' ' HB2' ' A' ' 23' ' ' CYS . 0.0 OUTLIER -130.71 4.3 4.57 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 112.06 0.392 . . . . 0.0 112.06 -179.434 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.546 ' CA ' ' HA ' ' A' ' 22' ' ' LEU . 82.4 p 44.63 -162.26 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.241 0 N-CA-C 110.22 -0.289 . . . . 0.0 110.22 -179.17 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.583 ' C ' ' CG2' ' A' ' 1' ' ' ILE . 71.4 p -99.03 123.05 43.06 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 179.291 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 5.1 p30 167.67 179.19 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.908 0.385 . . . . 0.0 111.046 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.67 58.67 3.35 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.395 179.52 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 65' ' ' CYS . . . . . 0.459 ' O ' ' O ' ' A' ' 66' ' ' ASN . 0.6 OUTLIER -59.49 -70.88 0.14 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.613 179.983 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.531 ' HB3' ' CG ' ' A' ' 4' ' ' HIS . 1.3 p-10 49.69 161.64 0.04 OUTLIER Pre-proline 0 N--CA 1.463 0.22 0 CA-C-N 115.576 -0.738 . . . . 0.0 112.413 179.761 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 16.9 Cg_exo -68.64 62.16 1.2 Allowed 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 123.193 2.596 . . . . 0.0 112.6 -179.6 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 56.7 p-80 -59.22 109.39 1.87 Allowed Pre-proline 0 C--N 1.328 -0.369 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.702 179.76 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' PRO . . . . . 0.442 ' HG3' ' HA ' ' B' ' 192' ' ' CYS . 52.4 Cg_exo -53.3 124.72 16.36 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.305 2.003 . . . . 0.0 111.989 -179.917 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.469 ' HG3' ' HG2' ' A' ' 38' ' ' LYS . 0.0 OUTLIER -90.79 -2.99 57.75 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.728 -179.487 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.419 ' HB2' ' CE ' ' A' ' 38' ' ' LYS . 31.7 tt0 . . . . . 0 C--N 1.331 -0.221 0 CA-C-N 116.612 -0.267 . . . . 0.0 111.379 -179.887 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 192' ' ' CYS . . . . . 0.717 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.0 OUTLIER . . . . . 0 CA--C 1.499 -0.999 0 CA-C-O 122.162 0.982 . . . . 0.0 111.87 . . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 193' ' ' CYS . . . . . 0.717 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.1 OUTLIER 43.93 81.41 0.25 Allowed Pre-proline 0 N--CA 1.441 -0.896 0 CA-C-N 113.114 -1.857 . . . . 0.0 112.6 173.507 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 194' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -83.36 -43.27 0.08 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.552 0 C-N-CA 122.69 2.26 . . . . 0.0 112.213 179.591 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -43.48 98.88 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.498 -179.948 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 196' ' ' THR . . . . . 0.7 ' N ' ' HD3' ' B' ' 197' ' ' PRO . 2.9 p -149.83 45.42 0.36 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.821 179.868 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 197' ' ' PRO . . . . . 0.7 ' HD3' ' N ' ' B' ' 196' ' ' THR . 2.5 Cg_endo -77.17 11.61 2.02 Favored 'Trans proline' 0 N--CA 1.455 -0.773 0 C-N-CA 121.851 1.701 . . . . 0.0 108.537 175.981 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 198' ' ' TYR . . . . . 0.534 ' H ' ' C ' ' B' ' 196' ' ' THR . 10.9 t80 . . . . . 0 C--O 1.249 1.063 0 CA-C-N 113.746 -1.57 . . . . 0.0 111.27 -178.796 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 19.2 mm . . . . . 0 N--CA 1.485 1.278 0 CA-C-O 120.846 0.355 . . . . 0.0 111.132 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 0.562 HG12 ' HA ' ' A' ' 15' ' ' THR . 27.7 m -136.19 169.78 19.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.99 179.839 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.456 ' H ' HG12 ' A' ' 14' ' ' VAL . 3.2 t -160.31 100.65 1.36 Allowed 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 -179.536 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' HIS . . . . . 0.779 ' HA ' HG13 ' A' ' 14' ' ' VAL . 4.5 m-70 -36.01 120.36 0.62 Allowed 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.48 179.392 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.649 HG23 ' HB2' ' A' ' 12' ' ' SER . 0.8 OUTLIER -84.44 99.86 10.95 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.978 -179.995 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.445 ' CG2' ' N ' ' A' ' 7' ' ' ALA . 0.4 OUTLIER 81.17 -53.97 0.3 Allowed 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.213 179.784 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.489 ' O ' ' N ' ' A' ' 9' ' ' SER . . . 58.98 -96.14 0.06 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.681 -0.236 . . . . 0.0 110.884 -179.688 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.474 ' OG1' ' N ' ' A' ' 9' ' ' SER . 5.3 p 62.01 -68.87 0.06 Allowed 'General case' 0 CA--C 1.529 0.156 0 CA-C-O 120.673 0.273 . . . . 0.0 111.396 179.666 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.489 ' N ' ' O ' ' A' ' 7' ' ' ALA . 0.6 OUTLIER -136.28 -67.02 0.02 OUTLIER Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.997 179.873 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.461 ' HD3' ' CB ' ' A' ' 9' ' ' SER . 97.1 Cg_endo -77.52 -123.88 0.01 OUTLIER 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 122.13 1.887 . . . . 0.0 111.738 179.86 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 18.7 tt 179.77 158.2 0.11 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.105 0 CA-C-O 120.822 0.344 . . . . 0.0 111.053 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.649 ' HB2' HG23 ' A' ' 5' ' ' THR . 0.4 OUTLIER -136.88 -172.26 3.14 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.909 179.881 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.39 91.82 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.755 -179.62 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.779 HG13 ' HA ' ' A' ' 4' ' ' HIS . 0.2 OUTLIER -72.93 -166.54 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.42 179.473 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.562 ' HA ' HG12 ' A' ' 2' ' ' VAL . 1.6 p 75.17 130.32 0.04 OUTLIER 'General case' 0 N--CA 1.462 0.173 0 CA-C-O 121.029 0.442 . . . . 0.0 111.562 179.575 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 41.5 t -113.72 94.31 32.37 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.6 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.467 ' N ' ' HD2' ' A' ' 18' ' ' PRO . 46.2 Cg_exo -55.22 -47.66 25.01 Favored 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.549 2.166 . . . . 0.0 112.691 -179.838 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.467 ' HD2' ' N ' ' A' ' 17' ' ' PRO . 71.8 Cg_endo -78.45 164.77 25.99 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.281 1.987 . . . . 0.0 112.36 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 48.37 87.12 0.01 OUTLIER Glycine 0 C--N 1.33 0.237 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.437 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -87.37 82.14 7.65 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.828 0.347 . . . . 0.0 111.263 -179.63 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -168.38 -74.49 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.968 179.73 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.958 HD23 ' CB ' ' A' ' 61' ' ' SER . 1.0 OUTLIER -125.45 154.42 42.03 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.018 -179.626 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.602 ' C ' ' H ' ' A' ' 44' ' ' CYS . 2.4 p -109.34 29.15 7.82 Favored 'General case' 0 CA--C 1.534 0.354 0 N-CA-C 112.228 0.455 . . . . 0.0 112.228 -179.172 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.64 ' O ' ' HB2' ' A' ' 60' ' ' CYS . 1.9 m-85 34.82 -159.25 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 122.774 0.43 . . . . 0.0 111.654 179.385 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.603 ' HB3' ' CB ' ' A' ' 41' ' ' GLU . 1.2 mtp180 97.23 117.17 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 122.591 0.356 . . . . 0.0 111.513 179.749 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.751 ' HB2' ' HA ' ' A' ' 57' ' ' VAL . 0.3 OUTLIER -147.98 -93.82 0.08 Allowed 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.236 178.725 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 1.9 mtm 172.15 -164.12 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.255 0 C-N-CA 121.108 -0.237 . . . . 0.0 110.773 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' TRP . . . . . 0.796 ' HB3' HG11 ' A' ' 39' ' ' VAL . 18.1 t-105 -133.18 -84.53 0.46 Allowed 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 116.592 -0.276 . . . . 0.0 111.062 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER 54.53 175.14 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 120.813 0.339 . . . . 0.0 110.726 -179.63 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -86.21 -76.23 0.35 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.983 0.421 . . . . 0.0 110.277 179.456 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -118.1 -130.67 0.3 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.854 179.251 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.468 ' O ' ' N ' ' A' ' 34' ' ' SER . 26.7 p90 -68.47 -35.89 78.19 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 179.121 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER 34.62 -86.19 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 115.345 -0.843 . . . . 0.0 112.771 179.485 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.468 ' N ' ' O ' ' A' ' 32' ' ' PHE . 0.3 OUTLIER 78.32 28.54 0.48 Allowed 'General case' 0 N--CA 1.462 0.173 0 CA-C-O 120.967 0.413 . . . . 0.0 110.338 -179.175 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 1.6 p -152.95 -66.41 0.16 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.621 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -86.45 -155.36 0.25 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.718 179.821 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.713 ' O ' HG22 ' A' ' 39' ' ' VAL . . . 88.91 20.19 47.88 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.711 -0.756 . . . . 0.0 112.49 -179.574 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.454 ' HA ' ' HG3' ' A' ' 70' ' ' LYS . 0.1 OUTLIER -39.38 95.33 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 121.227 0.537 . . . . 0.0 111.629 -179.726 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.796 HG11 ' HB3' ' A' ' 28' ' ' TRP . 30.2 m -145.75 -151.53 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.436 -0.802 . . . . 0.0 109.666 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 1.031 HG13 HG23 ' B' ' 191' ' ' THR . 0.2 OUTLIER -150.03 -171.18 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.11 0 C-N-CA 120.368 -0.533 . . . . 0.0 112.028 -179.995 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.603 ' CB ' ' HB3' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -108.06 155.2 20.65 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.297 -178.629 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.982 HD13 ' CG1' ' A' ' 57' ' ' VAL . 0.5 OUTLIER -64.46 -88.08 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 111.869 0.322 . . . . 0.0 111.869 -179.71 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.459 ' N ' ' HG2' ' A' ' 25' ' ' ARG . . . 126.91 83.94 0.48 Allowed Glycine 0 C--N 1.335 0.518 0 C-N-CA 119.664 -1.255 . . . . 0.0 113.336 179.753 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.602 ' H ' ' C ' ' A' ' 23' ' ' CYS . 0.1 OUTLIER 62.79 144.66 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.17 0.509 . . . . 0.0 112.286 178.819 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.577 ' HB3' ' CE1' ' A' ' 24' ' ' TYR . . . -147.06 -68.78 0.25 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.747 179.33 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.573 ' HB2' ' O ' ' A' ' 45' ' ' ALA . . . 166.14 -37.01 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.666 179.863 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.63 ' HA ' HD12 ' A' ' 22' ' ' LEU . 10.4 t -178.78 173.21 1.27 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.637 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.531 ' N ' ' HD3' ' A' ' 49' ' ' PRO . 22.3 p -142.76 52.81 2.42 Favored Pre-proline 0 C--N 1.331 -0.196 0 N-CA-C 111.995 0.369 . . . . 0.0 111.995 -179.778 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.6 ' HD3' HG23 ' A' ' 47' ' ' THR . 32.3 Cg_exo -57.52 -21.64 47.11 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 121.849 1.699 . . . . 0.0 110.82 178.526 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 3.5 t -61.46 -166.91 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.248 -0.887 . . . . 0.0 111.108 179.689 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 2.0 ptmm? 177.86 39.91 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.706 179.779 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.45 ' HD2' ' O ' ' A' ' 52' ' ' LYS . 0.0 OUTLIER -76.92 154.99 83.05 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.141 -179.924 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -71.19 -89.58 0.0 OUTLIER 'Trans proline' 0 CA--C 1.531 0.365 0 C-N-CA 122.457 2.105 . . . . 0.0 112.184 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -81.08 127.43 32.61 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 120.597 0.237 . . . . 0.0 110.603 179.779 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.514 ' O ' ' HB2' ' A' ' 56' ' ' GLU . 3.1 mm-40 -156.07 -78.61 0.09 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.478 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.516 ' C ' HG12 ' A' ' 57' ' ' VAL . 13.4 tt0 166.34 -28.36 0.0 OUTLIER 'General case' 0 C--N 1.334 -0.089 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.896 -179.663 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.982 ' CG1' HD13 ' A' ' 42' ' ' LEU . 0.3 OUTLIER -167.97 160.03 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.174 0 CA-C-O 121.386 0.612 . . . . 0.0 111.929 179.962 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.48 ' N ' HG23 ' A' ' 57' ' ' VAL . 0.2 OUTLIER -122.84 -67.42 0.95 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 114.957 -1.02 . . . . 0.0 109.967 179.192 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 59' ' ' CYS . . . . . 0.825 ' CB ' HD13 ' A' ' 22' ' ' LEU . 1.3 p 178.73 146.88 0.17 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.552 179.425 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.64 ' HB2' ' O ' ' A' ' 24' ' ' TYR . 11.9 m -133.96 84.68 2.14 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.462 -179.256 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.958 ' CB ' HD23 ' A' ' 22' ' ' LEU . 2.1 t -93.58 74.75 4.4 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.91 0.386 . . . . 0.0 110.832 179.879 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.417 HG22 ' H ' ' A' ' 63' ' ' ASP . 0.2 OUTLIER -157.95 -164.28 1.49 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.7 -179.999 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ASP . . . . . 0.417 ' H ' HG22 ' A' ' 62' ' ' THR . 10.8 p-10 -124.61 28.25 6.63 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.197 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER 179.54 43.81 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.05 0.452 . . . . 0.0 110.776 179.776 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 13.5 t -77.79 -27.23 50.15 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.084 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -58.52 105.32 0.52 Allowed Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.456 -179.65 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 7.1 Cg_exo -73.51 -156.16 0.05 OUTLIER 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.757 2.305 . . . . 0.0 111.908 179.576 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.423 ' CB ' ' HD2' ' A' ' 69' ' ' PRO . 0.7 OUTLIER -106.77 166.59 10.85 Favored Pre-proline 0 C--N 1.331 -0.211 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.818 179.831 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.423 ' HD2' ' CB ' ' A' ' 68' ' ' HIS . 9.9 Cg_endo -53.47 177.33 0.07 OUTLIER 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.619 2.212 . . . . 0.0 112.528 -179.845 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.454 ' HG3' ' HA ' ' A' ' 38' ' ' LYS . 3.0 mmpt? -85.11 -56.48 3.53 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.351 -179.623 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 31.7 mt-30 -42.74 -65.21 0.5 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.446 -179.682 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -122.34 88.73 49.0 Favored Pre-proline 0 C--N 1.33 -0.255 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.821 179.76 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -75.42 -44.44 0.31 Allowed 'Trans proline' 0 C--N 1.343 0.287 0 C-N-CA 122.576 2.184 . . . . 0.0 112.387 -179.89 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.094 0 CA-C-O 118.367 -1.241 . . . . 0.0 112.426 -179.968 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 181' ' ' TYR . . . . . . . . . . . . . 24.0 m-85 . . . . . 0 N--CA 1.487 1.41 0 CA-C-O 120.814 0.34 . . . . 0.0 111.157 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 182' ' ' ARG . . . . . . . . . . . . . 7.5 tpp180 -99.76 133.28 44.34 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.942 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 183' ' ' GLY . . . . . . . . . . . . . . . -145.67 -46.18 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.586 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 184' ' ' TRP . . . . . 0.416 ' HA ' ' CE3' ' B' ' 184' ' ' TRP . 4.2 m95 59.74 23.13 11.99 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.785 0.326 . . . . 0.0 110.989 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 185' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -47.56 158.43 0.19 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.251 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 186' ' ' HIS . . . . . . . . . . . . . 2.5 t-160 -89.27 126.97 35.73 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.958 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 187' ' ' TRP . . . . . 0.424 ' HD1' HG23 ' B' ' 188' ' ' VAL . 0.0 OUTLIER -47.24 -89.53 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.924 179.933 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 188' ' ' VAL . . . . . 0.591 ' HB ' HG12 ' A' ' 39' ' ' VAL . 0.2 OUTLIER -79.83 -171.48 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.67 0.271 . . . . 0.0 110.469 179.587 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 189' ' ' TYR . . . . . 0.502 ' H ' HG12 ' B' ' 188' ' ' VAL . 0.0 OUTLIER -100.63 -165.75 1.24 Allowed 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 116.575 -0.284 . . . . 0.0 110.504 -179.822 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 190' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -146.02 145.76 30.72 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.817 0.342 . . . . 0.0 111.046 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 191' ' ' THR . . . . . 1.031 HG23 HG13 ' A' ' 40' ' ' VAL . 0.2 OUTLIER -89.62 -76.27 0.42 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.253 -179.708 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 192' ' ' CYS . . . . . 0.702 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.0 OUTLIER -42.93 170.27 0.0 OUTLIER 'General case' 0 CA--C 1.499 -0.988 0 CA-C-O 122.06 0.933 . . . . 0.0 112.101 -179.738 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 193' ' ' CYS . . . . . 0.702 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.1 OUTLIER 41.09 68.6 2.37 Favored Pre-proline 0 C--N 1.314 -0.948 0 CA-C-N 113.149 -1.842 . . . . 0.0 112.209 173.817 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 194' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -73.1 -70.72 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.845 2.363 . . . . 0.0 112.422 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 166.56 -20.69 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.465 -179.907 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 196' ' ' THR . . . . . 0.756 ' C ' ' H ' ' B' ' 198' ' ' TYR . 0.6 OUTLIER -79.36 -20.84 0.33 Allowed Pre-proline 0 C--N 1.331 -0.198 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -179.744 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 197' ' ' PRO . . . . . 0.685 ' CD ' ' N ' ' B' ' 196' ' ' THR . 17.8 Cg_exo -64.26 25.13 0.07 OUTLIER 'Trans proline' 0 C--N 1.353 0.815 0 C-N-CA 121.218 1.279 . . . . 0.0 109.575 176.733 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 198' ' ' TYR . . . . . 0.756 ' H ' ' C ' ' B' ' 196' ' ' THR . 5.6 t80 . . . . . 0 C--O 1.248 1.022 0 CA-C-N 114.372 -1.285 . . . . 0.0 111.346 -178.74 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' ILE . . . . . 0.654 HD13 ' N ' ' A' ' 1' ' ' ILE . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.375 0 CA-C-O 120.989 0.423 . . . . 0.0 111.131 . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 0.424 HG12 ' HA ' ' A' ' 15' ' ' THR . 9.9 m -132.38 -179.56 3.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.351 179.496 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.545 ' N ' HG23 ' A' ' 14' ' ' VAL . 7.9 t -135.16 118.09 16.29 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.594 -0.442 . . . . 0.0 112.114 -179.927 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' HIS . . . . . 0.562 ' CA ' ' HB ' ' A' ' 14' ' ' VAL . 1.0 OUTLIER -35.07 143.55 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.343 179.356 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.445 HG22 ' H ' ' A' ' 6' ' ' THR . 0.2 OUTLIER -57.34 -164.23 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.47 -179.306 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.445 ' H ' HG22 ' A' ' 5' ' ' THR . 13.9 t -90.6 42.64 1.11 Allowed 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 112.295 0.479 . . . . 0.0 112.295 -178.778 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 1.027 ' HB3' ' CG2' ' A' ' 11' ' ' ILE . . . -150.52 -178.6 6.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.53 0.205 . . . . 0.0 111.003 179.312 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.945 HG23 ' HD3' ' A' ' 10' ' ' PRO . 0.5 OUTLIER -58.46 -109.44 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 116.687 -0.233 . . . . 0.0 110.966 -179.521 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.644 ' N ' ' CD ' ' A' ' 10' ' ' PRO . 81.6 p -122.92 0.86 0.06 OUTLIER Pre-proline 0 CA--C 1.545 0.772 0 N-CA-C 114.791 1.404 . . . . 0.0 114.791 -178.951 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.945 ' HD3' HG23 ' A' ' 8' ' ' THR . 77.4 Cg_endo -78.74 -23.28 8.32 Favored 'Trans proline' 0 C--N 1.355 0.877 0 C-N-CA 121.549 1.5 . . . . 0.0 111.98 179.878 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 1.027 ' CG2' ' HB3' ' A' ' 7' ' ' ALA . 0.1 OUTLIER -53.18 -163.96 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.625 -0.716 . . . . 0.0 112.068 -179.38 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.4 t -173.33 -36.56 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.859 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.27 66.46 0.11 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.796 179.811 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.562 ' HB ' ' CA ' ' A' ' 4' ' ' HIS . 0.5 OUTLIER -112.83 135.51 52.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.764 -179.761 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.621 ' OG1' ' CD ' ' A' ' 17' ' ' PRO . 1.7 t 157.11 125.61 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 116.007 -0.542 . . . . 0.0 109.607 -179.177 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.632 ' N ' ' CD ' ' A' ' 17' ' ' PRO . 0.5 OUTLIER -117.59 26.21 0.11 Allowed Pre-proline 0 CA--C 1.542 0.669 0 N-CA-C 113.757 1.021 . . . . 0.0 113.757 -178.364 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.632 ' CD ' ' N ' ' A' ' 16' ' ' CYS . 77.9 Cg_exo -46.07 -49.78 10.83 Favored 'Trans proline' 0 C--N 1.349 0.572 0 C-N-CA 122.416 2.077 . . . . 0.0 113.461 179.615 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.628 ' HD2' ' N ' ' A' ' 17' ' ' PRO . 5.7 Cg_endo -48.97 -177.49 0.01 OUTLIER 'Trans proline' 0 C--N 1.351 0.685 0 C-N-CA 122.527 2.152 . . . . 0.0 112.766 -179.209 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.406 ' O ' ' CB ' ' A' ' 20' ' ' GLU . . . -42.25 91.03 0.01 OUTLIER Glycine 0 C--N 1.334 0.452 0 CA-C-N 116.0 -0.546 . . . . 0.0 113.164 -179.606 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.439 ' N ' ' O ' ' A' ' 18' ' ' PRO . 1.6 mt-10 162.95 -173.46 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 122.595 0.358 . . . . 0.0 110.2 -179.87 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 8.1 m-20 -178.94 -79.47 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.806 0.336 . . . . 0.0 111.194 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.703 HD21 ' N ' ' A' ' 60' ' ' CYS . 3.5 tm? -59.05 91.72 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.316 -179.725 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.547 ' HA ' ' HA ' ' A' ' 44' ' ' CYS . 4.6 t -66.02 63.06 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 120.738 0.304 . . . . 0.0 111.272 179.828 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.526 ' N ' HD13 ' A' ' 22' ' ' LEU . 6.7 p90 -47.88 145.27 3.0 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.019 0.438 . . . . 0.0 111.933 -179.62 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.579 ' HD3' HG23 ' A' ' 40' ' ' VAL . 0.0 OUTLIER -138.26 137.76 37.8 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.485 179.744 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -78.25 150.48 33.4 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.955 -179.886 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' MET . . . . . 0.432 ' O ' ' N ' ' A' ' 29' ' ' CYS . 14.7 ptm -143.54 79.29 1.63 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.976 179.885 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' TRP . . . . . 0.759 ' HB2' HG11 ' A' ' 39' ' ' VAL . 69.2 t-105 -58.63 79.77 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.341 -179.831 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' CYS . . . . . 0.432 ' N ' ' O ' ' A' ' 27' ' ' MET . 0.5 OUTLIER -170.02 119.02 0.6 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.074 179.762 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.79 -162.01 0.59 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.77 179.949 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -56.37 -38.13 71.01 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.328 -179.936 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 27.3 m-85 -102.96 -79.17 0.53 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.921 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.477 ' O ' ' N ' ' A' ' 35' ' ' SER . 19.5 p 38.22 30.77 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 112.208 0.447 . . . . 0.0 112.208 179.773 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.3 m 48.46 -86.9 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 116.594 -0.276 . . . . 0.0 111.392 -179.989 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.477 ' N ' ' O ' ' A' ' 33' ' ' CYS . 97.6 p -176.49 71.23 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.787 0.327 . . . . 0.0 110.841 179.803 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 20.8 mtt180 -115.05 -87.93 0.58 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.1 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.412 ' HA2' ' O ' ' A' ' 28' ' ' TRP . . . 51.6 23.32 9.63 Favored Glycine 0 C--N 1.334 0.431 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.996 179.883 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.852 ' HE2' HG11 ' B' ' 188' ' ' VAL . 0.0 OUTLIER -82.31 51.14 1.75 Allowed 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 -179.422 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.759 HG11 ' HB2' ' A' ' 28' ' ' TRP . 3.2 p -135.41 12.39 1.05 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 CA-C-O 120.683 0.277 . . . . 0.0 110.993 179.089 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.758 HG13 ' OG1' ' B' ' 191' ' ' THR . 12.5 p -47.57 153.37 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.334 -0.107 0 CA-C-O 121.185 0.517 . . . . 0.0 112.185 -179.101 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.413 ' N ' HG22 ' A' ' 40' ' ' VAL . 0.0 OUTLIER -174.68 131.32 0.34 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.282 179.819 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.471 HD23 ' N ' ' A' ' 42' ' ' LEU . 2.4 pt? -50.22 176.6 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.367 -179.503 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.495 ' HA3' ' CE1' ' A' ' 24' ' ' TYR . . . -159.69 -68.97 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.316 -0.945 . . . . 0.0 113.522 -179.529 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.547 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 0.0 OUTLIER 70.41 99.53 0.06 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.239 0.543 . . . . 0.0 111.277 -179.263 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -128.4 -139.49 0.24 Allowed 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 115.342 -0.845 . . . . 0.0 110.09 179.747 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -167.98 36.53 0.03 OUTLIER 'General case' 0 C--N 1.334 -0.1 0 O-C-N 122.253 -0.28 . . . . 0.0 111.658 179.772 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 6.8 t -176.81 40.89 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 120.99 -0.284 . . . . 0.0 111.718 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 63.5 m 39.24 73.23 0.83 Allowed Pre-proline 0 N--CA 1.466 0.355 0 CA-C-N 116.731 -0.213 . . . . 0.0 111.538 179.712 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.44 ' HG2' ' HB2' ' A' ' 24' ' ' TYR . 10.6 Cg_endo -53.14 -19.08 11.32 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.128 1.886 . . . . 0.0 110.847 178.601 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.439 ' HB2' ' HA ' ' A' ' 58' ' ' THR . 39.5 t -38.24 -74.19 0.04 OUTLIER 'General case' 0 N--CA 1.457 -0.088 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.983 179.347 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 23.3 mmtt 67.89 -161.87 0.21 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.581 -179.705 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.599 ' CB ' ' CD ' ' A' ' 53' ' ' PRO . 9.5 mmmt -96.6 -163.72 0.05 OUTLIER Pre-proline 0 CA--C 1.539 0.533 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.617 -179.522 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' PRO . . . . . 0.599 ' CD ' ' CB ' ' A' ' 52' ' ' LYS . 35.5 Cg_exo -39.98 -28.3 0.25 Allowed 'Trans proline' 0 C--N 1.356 0.945 0 C-N-CA 122.644 2.229 . . . . 0.0 114.484 -178.587 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' TYR . . . . . 0.456 ' CZ ' ' HB2' ' A' ' 52' ' ' LYS . 0.1 OUTLIER -50.16 -25.45 3.57 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 120.556 -0.458 . . . . 0.0 111.422 -179.723 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -135.92 -170.65 2.68 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.936 0.398 . . . . 0.0 111.033 179.526 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.407 ' HG2' ' O ' ' A' ' 27' ' ' MET . 0.4 OUTLIER -126.01 -30.77 2.93 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.964 -179.924 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.519 HG12 ' H ' ' A' ' 58' ' ' THR . 1.4 t -44.1 167.74 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.334 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.964 -179.422 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.519 ' H ' HG12 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -146.12 127.91 15.33 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.412 179.855 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 59' ' ' CYS . . . . . 0.457 ' HA ' HD11 ' A' ' 22' ' ' LEU . 1.6 t -50.63 105.79 0.11 Allowed 'General case' 0 C--O 1.232 0.183 0 CA-C-O 121.025 0.44 . . . . 0.0 110.239 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.703 ' N ' HD21 ' A' ' 22' ' ' LEU . 0.5 OUTLIER -78.31 -97.04 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 115.902 -0.59 . . . . 0.0 112.315 -178.522 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.502 ' N ' HD22 ' A' ' 22' ' ' LEU . 13.1 t 39.1 88.18 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 111.608 0.225 . . . . 0.0 111.608 -179.516 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.513 HG23 ' H ' ' A' ' 63' ' ' ASP . 0.7 OUTLIER 175.75 -59.49 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 111.791 0.293 . . . . 0.0 111.791 179.983 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ASP . . . . . 0.513 ' H ' HG23 ' A' ' 62' ' ' THR . 8.6 m-20 -130.76 -158.8 0.92 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.784 0.326 . . . . 0.0 111.381 -179.251 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.443 ' HB3' ' CG ' ' A' ' 4' ' ' HIS . 0.7 OUTLIER -77.49 -2.43 35.44 Favored 'General case' 0 N--CA 1.461 0.124 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.975 -179.467 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 56.1 m 36.02 42.26 0.16 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.952 -0.567 . . . . 0.0 112.354 179.39 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.405 ' N ' ' HD3' ' A' ' 67' ' ' PRO . 2.3 m-80 -133.4 53.03 9.5 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 120.695 0.283 . . . . 0.0 111.491 179.965 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' PRO . . . . . 0.405 ' HD3' ' N ' ' A' ' 66' ' ' ASN . 96.1 Cg_endo -79.81 -167.55 0.52 Allowed 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.534 2.156 . . . . 0.0 112.184 179.532 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 41.8 m80 -68.97 112.1 10.49 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.671 179.802 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.754 ' HB3' HG12 ' A' ' 40' ' ' VAL . 37.3 Cg_exo -60.9 -67.14 0.05 OUTLIER 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.476 2.117 . . . . 0.0 112.517 -179.536 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.565 ' HG3' ' CB ' ' A' ' 38' ' ' LYS . 1.0 OUTLIER -73.76 145.97 44.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.011 0.434 . . . . 0.0 111.087 -179.71 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -96.35 38.44 1.2 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.212 -179.715 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.4 ' HB3' ' HD2' ' A' ' 73' ' ' PRO . 0.8 OUTLIER 58.12 164.84 0.08 OUTLIER Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.898 179.887 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.4 ' HD2' ' HB3' ' A' ' 72' ' ' ARG . 50.8 Cg_exo -54.27 120.87 8.69 Favored 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.598 2.199 . . . . 0.0 112.31 -179.885 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.392 -1.227 . . . . 0.0 112.47 179.978 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 181' ' ' TYR . . . . . . . . . . . . . 83.1 t80 . . . . . 0 N--CA 1.486 1.364 0 CA-C-O 120.868 0.366 . . . . 0.0 111.177 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 182' ' ' ARG . . . . . . . . . . . . . 16.1 mtp85 -60.01 -67.84 0.35 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.813 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 183' ' ' GLY . . . . . 0.489 ' O ' ' CG ' ' B' ' 184' ' ' TRP . . . 57.81 163.93 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.775 179.793 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 184' ' ' TRP . . . . . 0.489 ' CG ' ' O ' ' B' ' 183' ' ' GLY . 2.4 p90 51.76 169.86 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.181 0.515 . . . . 0.0 111.87 179.885 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 185' ' ' LYS . . . . . . . . . . . . . 2.0 ptmt 171.59 -41.76 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.406 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 186' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -128.23 86.87 2.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.431 179.6 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 187' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -51.6 -84.88 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.681 -179.372 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 188' ' ' VAL . . . . . 0.852 HG11 ' HE2' ' A' ' 38' ' ' LYS . 2.8 p -95.93 143.05 12.83 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.411 0 CA-C-O 120.934 0.397 . . . . 0.0 111.476 -179.259 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 189' ' ' TYR . . . . . 0.681 ' CE2' HG22 ' A' ' 39' ' ' VAL . 13.4 p90 -106.86 103.49 12.93 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.762 -179.501 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 190' ' ' TYR . . . . . 0.409 ' HB3' ' O ' ' A' ' 38' ' ' LYS . 0.3 OUTLIER -95.82 161.13 14.14 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.735 179.284 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 191' ' ' THR . . . . . 0.758 ' OG1' HG13 ' A' ' 40' ' ' VAL . 91.1 m -80.35 -2.5 45.71 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.318 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 192' ' ' CYS . . . . . 0.685 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.0 OUTLIER -88.62 169.24 11.87 Favored 'General case' 0 CA--C 1.498 -1.034 0 CA-C-O 122.132 0.968 . . . . 0.0 111.399 179.816 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 193' ' ' CYS . . . . . 0.686 ' N ' ' HD3' ' B' ' 194' ' ' PRO . 0.1 OUTLIER 38.61 48.09 1.5 Allowed Pre-proline 0 C--N 1.314 -0.942 0 CA-C-N 112.995 -1.911 . . . . 0.0 112.843 174.12 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 194' ' ' PRO . . . . . 0.686 ' HD3' ' N ' ' B' ' 193' ' ' CYS . 57.3 Cg_endo -100.67 -69.6 0.0 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.966 0 C-N-CA 123.602 2.868 . . . . 0.0 112.838 -179.452 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -70.46 -84.75 0.03 OUTLIER 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.153 -0.476 . . . . 0.0 112.012 -179.131 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 196' ' ' THR . . . . . 0.629 ' C ' ' H ' ' B' ' 198' ' ' TYR . 10.2 t -160.17 52.04 0.43 Allowed Pre-proline 0 C--N 1.332 -0.16 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 -179.089 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 197' ' ' PRO . . . . . 0.6 ' HD3' ' N ' ' B' ' 196' ' ' THR . 2.6 Cg_exo -73.08 15.89 0.46 Allowed 'Trans proline' 0 N--CA 1.459 -0.514 0 C-N-CA 121.879 1.72 . . . . 0.0 108.73 175.848 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 198' ' ' TYR . . . . . 0.629 ' H ' ' C ' ' B' ' 196' ' ' THR . 51.4 t80 . . . . . 0 C--O 1.25 1.079 0 CA-C-N 113.939 -1.482 . . . . 0.0 111.176 -178.6 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 24.5 mm . . . . . 0 N--CA 1.486 1.355 0 CA-C-O 120.789 0.328 . . . . 0.0 111.068 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 0.706 HG21 HG22 ' A' ' 15' ' ' THR . 0.5 OUTLIER -155.0 -176.18 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.901 179.872 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.591 ' H ' HG22 ' A' ' 2' ' ' VAL . 21.6 m -103.45 -174.63 2.59 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.147 0.499 . . . . 0.0 111.561 -179.537 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' HIS . . . . . 0.473 ' O ' ' N ' ' A' ' 6' ' ' THR . 0.9 OUTLIER -139.53 97.59 3.31 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.925 179.307 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.435 HG21 ' CA ' ' A' ' 11' ' ' ILE . 1.1 m 28.63 36.78 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 114.673 -1.149 . . . . 0.0 112.71 -179.736 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.546 HG22 ' O ' ' A' ' 6' ' ' THR . 21.0 m 48.94 21.67 0.49 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.604 0.24 . . . . 0.0 111.624 -179.813 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 44.61 30.07 0.48 Allowed 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 120.756 0.313 . . . . 0.0 111.51 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.671 HG23 ' HB ' ' B' ' 191' ' ' THR . 30.2 m -121.89 -70.88 0.76 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.864 -179.824 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.416 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.3 OUTLIER -75.81 165.91 49.43 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.626 179.831 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.44 ' C ' HD13 ' A' ' 11' ' ' ILE . 6.3 Cg_endo -48.57 -73.73 0.04 OUTLIER 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.753 2.302 . . . . 0.0 112.103 179.884 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.44 HD13 ' C ' ' A' ' 10' ' ' PRO . 0.0 OUTLIER -150.1 146.43 16.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.829 179.609 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -170.2 154.16 4.82 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.87 -179.955 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -77.5 62.0 2.38 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.038 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.426 HG11 ' H ' ' A' ' 6' ' ' THR . 0.0 OUTLIER -40.58 -83.23 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.385 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.621 -179.802 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.706 HG22 HG21 ' A' ' 2' ' ' VAL . 31.0 p 47.57 89.4 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 120.795 0.331 . . . . 0.0 111.109 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 10.0 t -59.44 136.05 88.94 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.022 -179.862 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -52.89 168.2 0.53 Allowed 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.433 2.089 . . . . 0.0 112.297 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -63.58 161.21 32.66 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.509 2.139 . . . . 0.0 112.214 179.884 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 46.78 70.85 0.61 Allowed Glycine 0 CA--C 1.518 0.23 0 C-N-CA 120.957 -0.639 . . . . 0.0 112.66 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -151.2 -177.28 5.95 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.894 0.378 . . . . 0.0 111.046 -179.785 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.671 ' HB3' ' HB3' ' A' ' 45' ' ' ALA . 0.8 OUTLIER -107.25 69.59 0.76 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.959 -179.954 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.466 ' HB3' ' H ' ' A' ' 23' ' ' CYS . 0.2 OUTLIER 49.88 -96.41 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.795 -0.639 . . . . 0.0 112.256 179.585 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.602 ' C ' ' H ' ' A' ' 44' ' ' CYS . 0.9 OUTLIER -158.66 30.76 0.23 Allowed 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 113.268 0.84 . . . . 0.0 113.268 -178.485 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.574 ' HB3' ' HA ' ' A' ' 42' ' ' LEU . 0.1 OUTLIER 55.07 161.21 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 118.2 0.454 . . . . 0.0 110.788 178.624 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.772 ' HA ' HD22 ' A' ' 42' ' ' LEU . 0.8 OUTLIER -150.93 63.32 0.92 Allowed 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.503 0.557 . . . . 0.0 112.503 179.841 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.678 ' HD2' HG11 ' A' ' 57' ' ' VAL . 0.5 OUTLIER -51.02 132.93 27.69 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.087 0.47 . . . . 0.0 111.62 179.853 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 2.7 ptp -152.96 110.34 3.53 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.342 179.578 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' TRP . . . . . 0.673 ' HB2' HG11 ' A' ' 39' ' ' VAL . 26.4 t90 -79.89 -78.77 0.16 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.583 -179.314 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' CYS . . . . . 0.443 ' O ' ' O ' ' A' ' 30' ' ' ASP . 2.4 t 52.62 -89.98 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.303 -178.995 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.443 ' O ' ' O ' ' A' ' 29' ' ' CYS . 82.9 m-20 44.93 -177.31 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 120.953 0.406 . . . . 0.0 111.894 179.223 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . 39.45 -145.72 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.405 179.757 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -92.49 44.72 1.17 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.872 0.367 . . . . 0.0 110.889 179.707 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 6.2 p -55.66 125.49 21.37 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.796 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 2.8 m -48.22 -52.94 18.78 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.513 -179.679 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.428 ' CB ' ' HB2' ' A' ' 70' ' ' LYS . 1.3 m -137.79 166.96 22.72 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.041 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 2.5 mtm-85 -89.32 108.66 19.75 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.899 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.402 ' N ' ' HB3' ' A' ' 70' ' ' LYS . . . 163.46 -163.54 35.69 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.404 -0.903 . . . . 0.0 112.579 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.436 ' HB2' ' HG2' ' A' ' 70' ' ' LYS . 0.0 OUTLIER 56.58 168.69 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.686 0.279 . . . . 0.0 110.702 -179.816 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.673 HG11 ' HB2' ' A' ' 28' ' ' TRP . 18.3 t 62.88 27.65 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 121.024 0.44 . . . . 0.0 110.232 -179.029 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 33.7 m -67.54 -177.43 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.762 -179.463 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 177.61 -63.34 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.52 179.882 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.772 HD22 ' HA ' ' A' ' 25' ' ' ARG . 0.4 OUTLIER 56.59 169.57 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.95 179.788 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 152.9 36.64 0.03 OUTLIER Glycine 0 CA--C 1.523 0.555 0 C-N-CA 119.985 -1.102 . . . . 0.0 114.358 179.58 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.602 ' H ' ' C ' ' A' ' 23' ' ' CYS . 87.6 m 58.69 114.93 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 117.128 0.464 . . . . 0.0 111.611 179.122 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.671 ' HB3' ' HB3' ' A' ' 21' ' ' ASN . . . -85.84 169.65 13.14 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.964 179.639 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -110.34 -39.28 5.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.821 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.702 HG23 ' CD ' ' A' ' 49' ' ' PRO . 11.7 t -138.53 164.3 29.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.112 179.724 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.615 ' N ' ' HD3' ' A' ' 49' ' ' PRO . 0.9 OUTLIER -132.59 44.45 1.33 Allowed Pre-proline 0 CA--C 1.532 0.254 0 N-CA-C 112.762 0.652 . . . . 0.0 112.762 -179.077 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.702 ' CD ' HG23 ' A' ' 47' ' ' THR . 55.4 Cg_endo -91.43 18.38 1.22 Allowed 'Trans proline' 0 N--CA 1.455 -0.789 0 C-N-CA 122.517 2.144 . . . . 0.0 110.518 177.817 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.462 ' O ' ' CD ' ' A' ' 52' ' ' LYS . 9.8 t -105.71 -112.99 0.26 Allowed 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 115.283 -0.871 . . . . 0.0 111.427 -178.412 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.436 ' CG ' ' O ' ' A' ' 50' ' ' SER . 0.6 OUTLIER 51.99 24.94 2.85 Favored 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 122.437 0.295 . . . . 0.0 111.681 -179.847 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.711 ' HB2' ' HD3' ' A' ' 53' ' ' PRO . 0.3 OUTLIER -143.3 -54.19 0.02 OUTLIER Pre-proline 0 CA--C 1.533 0.301 0 N-CA-C 111.935 0.346 . . . . 0.0 111.935 179.527 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 53' ' ' PRO . . . . . 0.711 ' HD3' ' HB2' ' A' ' 52' ' ' LYS . 15.3 Cg_exo -69.3 153.62 70.76 Favored 'Trans proline' 0 C--N 1.35 0.639 0 C-N-CA 122.253 1.969 . . . . 0.0 112.565 -179.633 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -77.14 75.29 3.71 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.505 179.777 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -105.71 -67.95 0.9 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.01 -179.49 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 173.55 -36.64 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.621 -179.821 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.884 HG13 ' H ' ' A' ' 58' ' ' THR . 2.4 p 179.69 -100.45 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.404 0 CA-C-N 115.949 -0.568 . . . . 0.0 111.491 179.697 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.884 ' H ' HG13 ' A' ' 57' ' ' VAL . 0.2 OUTLIER 85.98 31.17 0.04 OUTLIER 'General case' 0 CA--C 1.52 -0.186 0 C-N-CA 123.285 0.634 . . . . 0.0 110.902 -179.455 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 59' ' ' CYS . . . . . 0.829 ' H ' HG22 ' A' ' 57' ' ' VAL . 15.4 m -167.94 158.51 10.65 Favored 'General case' 0 CA--C 1.528 0.117 0 CA-C-O 121.741 0.781 . . . . 0.0 112.814 179.716 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.44 ' O ' ' HB2' ' A' ' 22' ' ' LEU . 0.2 OUTLIER 170.47 129.35 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 114.241 -1.345 . . . . 0.0 109.159 178.646 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.456 ' HA ' ' CG ' ' A' ' 22' ' ' LEU . 16.1 p -176.78 170.55 2.34 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.916 0.388 . . . . 0.0 111.336 -179.238 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER 48.73 38.2 11.2 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.45 179.803 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 179.01 -174.64 0.19 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.769 179.813 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.512 ' HE3' HG12 ' A' ' 2' ' ' VAL . 12.8 mmtm -101.91 17.99 21.73 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.221 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' CYS . . . . . 0.417 ' HB2' ' O ' ' A' ' 64' ' ' LYS . 56.3 m 68.25 -49.62 0.55 Allowed 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 112.361 0.504 . . . . 0.0 112.361 179.499 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.476 ' O ' ' ND2' ' A' ' 66' ' ' ASN . 0.2 OUTLIER -32.53 98.18 0.12 Allowed Pre-proline 0 N--CA 1.469 0.522 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 -179.728 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -83.72 -101.73 0.0 OUTLIER 'Trans proline' 0 CA--C 1.536 0.598 0 C-N-CA 122.708 2.272 . . . . 0.0 112.348 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.418 ' CE1' ' HA2' ' A' ' 74' ' ' GLY . 1.8 t-80 175.47 132.08 0.15 Allowed Pre-proline 0 CA--C 1.531 0.228 0 O-C-N 122.343 -0.223 . . . . 0.0 110.875 179.836 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 68' ' ' HIS . 33.6 Cg_exo -59.97 155.22 45.62 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.511 2.141 . . . . 0.0 112.41 179.9 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.436 ' HG2' ' HB2' ' A' ' 38' ' ' LYS . 0.0 OUTLIER -97.5 -34.31 11.05 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.754 179.609 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -51.69 -62.04 1.88 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.904 0.383 . . . . 0.0 110.725 179.725 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.441 ' HB3' ' HD2' ' A' ' 73' ' ' PRO . 3.2 mmp_? -63.16 163.81 16.26 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.655 179.695 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.441 ' HD2' ' HB3' ' A' ' 72' ' ' ARG . 87.7 Cg_exo -44.24 -51.96 6.24 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.577 2.185 . . . . 0.0 112.541 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' GLY . . . . . 0.418 ' HA2' ' CE1' ' A' ' 68' ' ' HIS . . . . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.308 -1.273 . . . . 0.0 112.622 179.762 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 181' ' ' TYR . . . . . 0.44 ' O ' ' N ' ' B' ' 183' ' ' GLY . 0.4 OUTLIER . . . . . 0 N--CA 1.486 1.374 0 CA-C-O 120.705 0.288 . . . . 0.0 111.132 . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 182' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 44.23 -90.11 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.446 -179.925 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 183' ' ' GLY . . . . . 0.44 ' N ' ' O ' ' B' ' 181' ' ' TYR . . . 84.71 11.76 76.44 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.626 -0.797 . . . . 0.0 112.8 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 184' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -67.02 -168.24 0.07 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.75 0.309 . . . . 0.0 110.766 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 185' ' ' LYS . . . . . . . . . . . . . 21.5 tptp -71.68 151.5 43.6 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.983 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 186' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -149.81 -163.87 1.89 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.592 179.896 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 187' ' ' TRP . . . . . 0.446 ' HB2' ' CE2' ' B' ' 190' ' ' TYR . 33.3 p90 -48.45 161.98 0.11 Allowed 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.771 0.32 . . . . 0.0 110.998 179.913 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 188' ' ' VAL . . . . . 0.436 ' HB ' ' H ' ' B' ' 189' ' ' TYR . 0.2 OUTLIER -85.18 -94.03 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.137 -179.717 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 189' ' ' TYR . . . . . 0.436 ' H ' ' HB ' ' B' ' 188' ' ' VAL . 0.4 OUTLIER -160.67 113.48 2.0 Favored 'General case' 0 N--CA 1.455 -0.199 0 O-C-N 122.161 -0.337 . . . . 0.0 111.113 -179.787 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 190' ' ' TYR . . . . . 0.446 ' CE2' ' HB2' ' B' ' 187' ' ' TRP . 1.2 m-85 -120.19 85.21 2.35 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.903 0.382 . . . . 0.0 110.769 179.606 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 191' ' ' THR . . . . . 0.671 ' HB ' HG23 ' A' ' 8' ' ' THR . 21.7 p -90.38 -10.63 43.23 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.327 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 192' ' ' CYS . . . . . 0.698 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.0 OUTLIER -46.26 172.49 0.01 OUTLIER 'General case' 0 CA--C 1.499 -1.009 0 CA-C-O 121.629 0.728 . . . . 0.0 111.559 -179.957 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 193' ' ' CYS . . . . . 0.698 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.0 OUTLIER 46.96 112.95 0.0 OUTLIER Pre-proline 0 C--N 1.315 -0.933 0 CA-C-N 113.552 -1.658 . . . . 0.0 112.512 173.636 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 194' ' ' PRO . . . . . . . . . . . . . 80.3 Cg_exo -42.22 162.88 0.04 OUTLIER 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.709 2.273 . . . . 0.0 112.622 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -94.34 -15.23 24.58 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.792 -179.45 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 196' ' ' THR . . . . . 0.551 ' C ' ' H ' ' B' ' 198' ' ' TYR . 27.3 p -122.02 40.3 0.44 Allowed Pre-proline 0 C--N 1.331 -0.235 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 197' ' ' PRO . . . . . 0.544 ' CD ' ' N ' ' B' ' 196' ' ' THR . 94.2 Cg_endo -76.25 15.39 0.99 Allowed 'Trans proline' 0 N--CA 1.458 -0.59 0 C-N-CA 121.757 1.638 . . . . 0.0 108.906 176.123 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 198' ' ' TYR . . . . . 0.551 ' H ' ' C ' ' B' ' 196' ' ' THR . 46.5 t80 . . . . . 0 C--O 1.249 1.066 0 CA-C-N 113.947 -1.479 . . . . 0.0 111.338 -178.811 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' ILE . . . . . 0.525 HG23 ' HA ' ' A' ' 62' ' ' THR . 27.4 mm . . . . . 0 N--CA 1.486 1.352 0 CA-C-O 120.761 0.315 . . . . 0.0 111.026 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 0.775 HG21 HG22 ' A' ' 15' ' ' THR . 8.2 p -176.9 150.02 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.876 -179.908 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.483 ' C ' ' CG ' ' A' ' 4' ' ' HIS . 3.8 p -111.99 -28.12 8.15 Favored 'General case' 0 C--O 1.224 -0.252 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 -179.193 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' HIS . . . . . 0.664 ' C ' HG12 ' A' ' 14' ' ' VAL . 0.0 OUTLIER 57.67 162.27 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.892 0.377 . . . . 0.0 110.682 -179.495 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.703 ' N ' HG12 ' A' ' 14' ' ' VAL . 1.4 m -96.4 35.93 1.42 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.485 -179.641 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.616 HG23 ' O ' ' A' ' 9' ' ' SER . 24.0 m -37.75 -34.5 0.11 Allowed 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.135 -179.919 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.915 ' HB3' HG13 ' A' ' 11' ' ' ILE . . . 34.79 80.66 0.02 OUTLIER 'General case' 0 N--CA 1.461 0.084 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.316 179.745 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.523 HG23 ' C ' ' A' ' 7' ' ' ALA . 1.9 p 80.15 -44.48 0.27 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.749 -0.659 . . . . 0.0 111.236 -179.546 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.616 ' O ' HG23 ' A' ' 6' ' ' THR . 0.0 OUTLIER -171.98 -68.4 0.0 OUTLIER Pre-proline 0 CA--C 1.535 0.374 0 N-CA-C 112.572 0.582 . . . . 0.0 112.572 179.741 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.471 ' HD3' ' CB ' ' A' ' 9' ' ' SER . 30.3 Cg_endo -84.11 -132.39 0.01 OUTLIER 'Trans proline' 0 CA--C 1.54 0.796 0 C-N-CA 122.333 2.022 . . . . 0.0 113.335 -178.744 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.915 HG13 ' HB3' ' A' ' 7' ' ' ALA . 24.5 mm 82.12 -110.38 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.511 0 C-N-CA 122.941 0.496 . . . . 0.0 111.699 -179.687 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.529 ' N ' HG22 ' A' ' 11' ' ' ILE . 1.2 m -161.96 -162.68 0.87 Allowed 'General case' 0 CA--C 1.53 0.183 0 O-C-N 121.978 -0.451 . . . . 0.0 111.609 -179.425 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -119.04 108.59 14.91 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.696 -179.52 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.703 HG12 ' N ' ' A' ' 5' ' ' THR . 0.2 OUTLIER -74.49 -56.51 8.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.165 179.568 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.775 HG22 HG21 ' A' ' 2' ' ' VAL . 5.5 p 66.58 128.42 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.389 -178.848 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.471 ' C ' ' CD ' ' A' ' 18' ' ' PRO . 1.7 m -130.13 68.65 81.29 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.098 -179.87 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.56 ' N ' ' CD ' ' A' ' 18' ' ' PRO . 61.6 Cg_endo -102.17 24.03 0.14 Allowed 'Trans proline' 0 CA--C 1.541 0.839 0 C-N-CA 123.417 2.745 . . . . 0.0 115.284 -178.979 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.56 ' CD ' ' N ' ' A' ' 17' ' ' PRO . 89.2 Cg_endo -82.96 -168.39 0.58 Allowed 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 121.659 1.572 . . . . 0.0 112.111 179.807 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -65.03 79.4 0.07 OUTLIER Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.55 -0.834 . . . . 0.0 111.967 179.669 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 66.42 118.08 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.903 0.382 . . . . 0.0 110.436 -179.47 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.467 ' O ' ' HB2' ' A' ' 22' ' ' LEU . 1.7 t-20 -146.05 -63.21 0.32 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.668 -179.735 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.773 HD13 ' HB3' ' A' ' 61' ' ' SER . 2.4 mm? 70.7 108.72 0.06 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.276 179.586 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.587 ' HA ' ' HA ' ' A' ' 44' ' ' CYS . 5.5 m -64.08 65.34 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 115.901 -0.591 . . . . 0.0 111.639 -179.784 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.57 ' CG ' ' HB2' ' A' ' 45' ' ' ALA . 0.1 OUTLIER -22.72 138.1 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 123.54 0.736 . . . . 0.0 112.639 179.985 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.585 ' CB ' HD23 ' A' ' 42' ' ' LEU . 0.2 OUTLIER -128.29 110.38 12.33 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.536 -179.683 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.865 ' HB3' HG12 ' A' ' 57' ' ' VAL . 1.5 ptpt -114.14 114.28 25.84 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.298 179.265 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -137.49 97.59 3.5 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.975 0.417 . . . . 0.0 111.272 -179.656 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' TRP . . . . . 0.859 ' CB ' HG21 ' A' ' 39' ' ' VAL . 0.0 OUTLIER -70.21 -165.8 0.11 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.741 179.453 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 29' ' ' CYS . . . . . 0.449 ' HB3' ' HA ' ' A' ' 33' ' ' CYS . 0.0 OUTLIER -132.22 -167.53 1.9 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.863 -179.249 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -90.31 -49.64 6.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.174 -179.816 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -155.5 -75.31 0.1 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.382 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.406 ' O ' ' CD2' ' A' ' 32' ' ' PHE . 33.7 t80 -90.44 14.08 13.94 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.42 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.449 ' HA ' ' HB3' ' A' ' 29' ' ' CYS . 93.9 m 48.84 79.67 0.07 Allowed 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.771 0.32 . . . . 0.0 111.088 -179.899 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 5.6 p -135.16 42.7 2.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.041 -179.831 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 60.84 35.22 19.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.014 179.831 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -129.76 31.08 4.79 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.871 179.889 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -104.81 -168.7 24.34 Favored Glycine 0 C--N 1.331 0.266 0 C-N-CA 120.83 -0.7 . . . . 0.0 112.643 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.87 27.85 0.18 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.737 0.303 . . . . 0.0 111.048 -179.89 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.859 HG21 ' CB ' ' A' ' 28' ' ' TRP . 23.6 t -78.01 132.24 32.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.664 179.675 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.731 HG21 ' HA ' ' B' ' 191' ' ' THR . 2.5 t -137.0 145.68 29.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.66 -178.877 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.604 ' H ' HD12 ' A' ' 42' ' ' LEU . 0.4 OUTLIER -176.86 -98.98 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.035 179.53 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.714 HD13 ' HA ' ' A' ' 67' ' ' PRO . 3.0 mp 57.46 157.6 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 120.623 0.249 . . . . 0.0 111.137 179.928 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 145.99 53.78 0.02 OUTLIER Glycine 0 C--N 1.335 0.518 0 C-N-CA 120.0 -1.095 . . . . 0.0 114.407 179.246 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.587 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 0.0 OUTLIER 57.32 157.87 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 117.373 0.587 . . . . 0.0 112.327 178.612 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.585 ' O ' ' HB3' ' A' ' 46' ' ' ALA . . . -151.11 -39.27 0.12 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.465 -0.788 . . . . 0.0 111.466 -179.718 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.585 ' HB3' ' O ' ' A' ' 45' ' ' ALA . . . 80.85 40.52 0.06 Allowed 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.975 -179.766 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.431 HG23 ' O ' ' A' ' 47' ' ' THR . 4.6 t -165.77 77.48 0.26 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.67 179.786 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.542 ' N ' ' HD2' ' A' ' 49' ' ' PRO . 52.9 t -69.07 -48.88 26.74 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.417 -179.737 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.542 ' HD2' ' N ' ' A' ' 48' ' ' CYS . 52.0 Cg_endo -69.89 58.95 1.66 Allowed 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 121.705 1.603 . . . . 0.0 110.04 178.628 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.426 ' N ' ' O ' ' A' ' 48' ' ' CYS . 42.8 t -110.0 -109.01 0.34 Allowed 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 114.977 -1.01 . . . . 0.0 111.057 -178.159 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.41 ' HG3' ' O ' ' A' ' 50' ' ' SER . 0.4 OUTLIER 36.17 77.54 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.323 0 N-CA-C 112.149 0.425 . . . . 0.0 112.149 179.808 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.55 ' HB2' ' HD3' ' A' ' 53' ' ' PRO . 0.0 OUTLIER -104.26 -56.4 0.09 OUTLIER Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.611 179.366 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 53' ' ' PRO . . . . . 0.55 ' HD3' ' HB2' ' A' ' 52' ' ' LYS . 11.8 Cg_endo -93.29 171.23 2.07 Favored 'Trans proline' 0 N--CA 1.453 -0.908 0 C-N-CA 123.167 2.578 . . . . 0.0 111.749 179.69 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -73.04 71.16 1.09 Allowed 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 120.842 0.353 . . . . 0.0 110.722 179.8 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -105.76 -150.57 0.44 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.289 -179.741 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.1 pm0 -140.18 15.84 2.43 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.216 -179.617 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.865 HG12 ' HB3' ' A' ' 26' ' ' LYS . 30.1 m -93.34 137.64 22.09 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-O 120.919 0.39 . . . . 0.0 111.385 -179.843 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 89.0 m -156.41 127.31 6.85 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.013 -179.946 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' CYS . . . . . 0.42 ' HB2' ' HG ' ' A' ' 22' ' ' LEU . 0.6 OUTLIER -43.44 133.75 4.2 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.89 179.773 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.571 ' HB2' ' O ' ' A' ' 23' ' ' CYS . 0.5 OUTLIER -114.97 -94.58 0.47 Allowed 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.905 -178.846 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.773 ' HB3' HD13 ' A' ' 22' ' ' LEU . 2.3 t 64.07 -76.48 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.79 0.329 . . . . 0.0 111.567 -179.848 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.525 ' HA ' HG23 ' A' ' 1' ' ' ILE . 9.3 t -44.22 134.05 5.07 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.135 -0.484 . . . . 0.0 112.044 -179.054 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 56.17 173.15 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.718 -0.673 . . . . 0.0 111.586 179.384 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.75 84.75 0.11 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.039 179.605 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -93.37 16.96 12.15 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.074 -0.512 . . . . 0.0 112.311 -178.705 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.481 ' OD1' ' CD2' ' A' ' 4' ' ' HIS . 0.2 OUTLIER -54.04 163.16 1.25 Allowed Pre-proline 0 N--CA 1.465 0.275 0 CA-C-O 120.908 0.385 . . . . 0.0 111.15 179.841 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 67' ' ' PRO . . . . . 0.714 ' HA ' HD13 ' A' ' 42' ' ' LEU . 59.6 Cg_exo -51.25 124.89 15.04 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.709 2.273 . . . . 0.0 112.307 179.78 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 11.8 m-70 -133.75 99.78 13.83 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.856 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -48.81 165.66 0.17 Allowed 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.571 2.181 . . . . 0.0 112.46 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.8 ptmt -114.83 -30.1 6.54 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.976 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.44 ' O ' ' N ' ' A' ' 73' ' ' PRO . 7.4 pt20 -60.39 -16.49 36.1 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.37 179.866 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.67 ' CB ' ' CD ' ' A' ' 73' ' ' PRO . 20.1 mtm180 28.96 -87.09 0.0 OUTLIER Pre-proline 0 CA--C 1.54 0.56 0 C-N-CA 123.183 0.593 . . . . 0.0 112.463 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.67 ' CD ' ' CB ' ' A' ' 72' ' ' ARG . 28.7 Cg_endo -62.2 -178.17 0.33 Allowed 'Trans proline' 0 C--N 1.354 0.846 0 C-N-CA 121.634 1.556 . . . . 0.0 111.915 179.582 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.353 -1.248 . . . . 0.0 112.399 -179.97 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 181' ' ' TYR . . . . . . . . . . . . . 1.7 p90 . . . . . 0 N--CA 1.488 1.466 0 N-CA-C 111.676 0.25 . . . . 0.0 111.676 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 182' ' ' ARG . . . . . . . . . . . . . 8.8 mmm-85 -108.3 63.49 0.61 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.895 0.379 . . . . 0.0 110.811 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 183' ' ' GLY . . . . . . . . . . . . . . . -59.33 113.21 4.94 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.388 -179.946 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 184' ' ' TRP . . . . . . . . . . . . . 39.8 p90 -59.22 133.57 56.21 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.85 0.357 . . . . 0.0 110.942 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 185' ' ' LYS . . . . . . . . . . . . . 45.8 tttp -58.61 131.0 49.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.905 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 186' ' ' HIS . . . . . . . . . . . . . 96.2 m-70 -84.08 99.7 10.63 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.905 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 187' ' ' TRP . . . . . 0.472 ' HB2' ' CE1' ' B' ' 189' ' ' TYR . 0.6 OUTLIER -49.96 158.24 0.53 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.365 -179.955 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 2.0 p -94.37 -21.24 5.89 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.467 -179.588 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 189' ' ' TYR . . . . . 0.829 ' CB ' HG22 ' A' ' 39' ' ' VAL . 35.1 p90 -79.47 73.18 6.13 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.828 0.347 . . . . 0.0 111.397 -179.345 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 190' ' ' TYR . . . . . 0.413 ' O ' ' C ' ' B' ' 191' ' ' THR . 0.0 OUTLIER -160.6 123.06 3.23 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.194 179.923 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 191' ' ' THR . . . . . 0.731 ' HA ' HG21 ' A' ' 40' ' ' VAL . 0.1 OUTLIER -31.23 144.94 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.597 179.523 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 192' ' ' CYS . . . . . 0.705 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.1 OUTLIER -55.71 -60.8 2.94 Favored 'General case' 0 CA--C 1.5 -0.944 0 CA-C-O 121.506 0.67 . . . . 0.0 112.149 -179.253 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 193' ' ' CYS . . . . . 0.705 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.0 OUTLIER -162.45 163.37 18.36 Favored Pre-proline 0 N--CA 1.436 -1.161 0 CA-C-N 114.278 -1.328 . . . . 0.0 111.752 -173.46 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 194' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -82.74 130.99 6.07 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.768 2.312 . . . . 0.0 112.051 179.604 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 195' ' ' ASP . . . . . 0.451 ' HB3' ' OG ' ' A' ' 9' ' ' SER . 8.1 p-10 -63.84 80.81 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.02 -179.908 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 196' ' ' THR . . . . . 0.687 ' N ' ' CD ' ' B' ' 197' ' ' PRO . 0.7 OUTLIER -118.34 5.43 0.08 OUTLIER Pre-proline 0 C--N 1.328 -0.328 0 N-CA-C 113.763 1.023 . . . . 0.0 113.763 -179.636 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 197' ' ' PRO . . . . . 0.687 ' CD ' ' N ' ' B' ' 196' ' ' THR . 73.9 Cg_endo -74.04 21.93 0.37 Allowed 'Trans proline' 0 C--N 1.354 0.827 0 CA-C-N 120.53 1.225 . . . . 0.0 109.042 176.471 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 198' ' ' TYR . . . . . 0.646 ' H ' ' C ' ' B' ' 196' ' ' THR . 0.2 OUTLIER . . . . . 0 C--O 1.25 1.081 0 CA-C-N 114.058 -1.428 . . . . 0.0 111.379 -178.753 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 1' ' ' ILE . . . . . 0.579 HD13 ' N ' ' A' ' 1' ' ' ILE . 0.1 OUTLIER . . . . . 0 N--CA 1.485 1.313 0 CA-C-O 120.94 0.4 . . . . 0.0 111.132 . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 0.701 HG12 ' HB ' ' A' ' 15' ' ' THR . 3.7 m -98.98 -171.02 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.735 179.751 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.568 ' C ' HG23 ' A' ' 14' ' ' VAL . 0.1 OUTLIER -148.14 88.33 1.65 Allowed 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 111.773 0.286 . . . . 0.0 111.773 -179.667 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 4' ' ' HIS . . . . . 0.922 ' N ' HG23 ' A' ' 14' ' ' VAL . 4.9 p-80 -59.0 126.79 29.17 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.888 0.375 . . . . 0.0 110.23 179.299 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.817 HG21 ' HB2' ' A' ' 12' ' ' SER . 75.0 p -47.21 -74.7 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.483 -179.395 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.41 ' N ' ' HB3' ' A' ' 10' ' ' PRO . 63.8 p 50.45 23.82 1.39 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.928 179.656 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -120.38 -161.12 0.86 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.564 -0.289 . . . . 0.0 110.327 179.436 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 1.3 t -49.01 96.81 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.146 0 CA-C-O 120.869 0.366 . . . . 0.0 110.066 179.45 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 1.6 m 69.63 77.66 0.23 Allowed Pre-proline 0 C--N 1.331 -0.235 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 -178.532 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.622 ' O ' HG22 ' A' ' 11' ' ' ILE . 29.7 Cg_endo -85.37 -135.38 0.02 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.403 0 C-N-CA 122.95 2.433 . . . . 0.0 112.034 -179.035 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.622 HG22 ' O ' ' A' ' 10' ' ' PRO . 1.1 tt 67.71 4.95 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.182 0 N-CA-C 112.579 0.585 . . . . 0.0 112.579 179.529 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.817 ' HB2' HG21 ' A' ' 5' ' ' THR . 0.2 OUTLIER -76.06 -166.85 0.65 Allowed 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 120.967 0.413 . . . . 0.0 111.649 -178.888 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -83.14 92.43 7.43 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.851 -0.613 . . . . 0.0 112.019 -179.217 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.922 HG23 ' N ' ' A' ' 4' ' ' HIS . 2.2 p -57.79 99.95 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.454 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.295 178.854 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.701 ' HB ' HG12 ' A' ' 2' ' ' VAL . 0.0 OUTLIER 169.67 116.83 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.831 0.348 . . . . 0.0 111.353 -179.446 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 30.1 t -114.17 137.77 22.63 Favored Pre-proline 0 C--N 1.332 -0.195 0 CA-C-N 116.278 -0.419 . . . . 0.0 109.963 178.969 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_exo -38.76 103.67 0.04 OUTLIER 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 122.901 2.401 . . . . 0.0 113.018 -179.769 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_exo -57.17 -160.25 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.724 2.283 . . . . 0.0 112.475 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 64.17 -86.67 0.07 OUTLIER Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.675 -0.774 . . . . 0.0 112.137 -179.809 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -105.07 142.32 35.06 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 110.252 -0.277 . . . . 0.0 110.252 179.53 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.408 ' HB3' ' N ' ' A' ' 45' ' ' ALA . 1.5 m-20 64.14 88.86 0.1 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.437 -179.617 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.466 ' HG ' ' CB ' ' A' ' 61' ' ' SER . 0.6 OUTLIER -73.66 -80.32 0.07 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.478 -179.49 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 8.4 m -158.52 29.04 0.23 Allowed 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 120.602 0.239 . . . . 0.0 111.546 -178.983 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.769 ' CD1' ' HB3' ' A' ' 45' ' ' ALA . 0.0 OUTLIER -83.49 161.93 21.09 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.075 0.464 . . . . 0.0 111.728 -178.973 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.533 ' CB ' ' HA ' ' A' ' 42' ' ' LEU . 0.9 OUTLIER -168.73 -79.08 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 115.718 -0.673 . . . . 0.0 110.973 178.889 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 177.7 165.97 0.66 Allowed 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.646 0.26 . . . . 0.0 110.767 179.844 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' MET . . . . . 0.407 ' O ' ' HG3' ' A' ' 56' ' ' GLU . 0.0 OUTLIER -152.09 -167.18 2.69 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.143 -179.918 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 28' ' ' TRP . . . . . 0.848 ' CB ' HG21 ' A' ' 39' ' ' VAL . 2.5 t-105 -148.38 179.02 8.1 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.447 179.756 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -173.59 99.32 0.11 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.837 0.351 . . . . 0.0 111.117 -179.901 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 50.2 t0 -66.05 137.51 57.13 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.555 179.728 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . 59.22 -156.29 0.34 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.524 -179.751 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 14.1 m-85 -82.59 53.11 2.25 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.823 0.344 . . . . 0.0 110.904 179.785 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 56.9 m 44.95 30.06 0.53 Allowed 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.308 -179.907 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 92.3 p -82.24 -31.67 30.09 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.62 179.824 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -130.15 114.67 16.01 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.621 179.78 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 33.1 mmm-85 -57.12 133.89 55.39 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.229 -179.732 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.417 ' O ' ' N ' ' A' ' 39' ' ' VAL . . . -113.65 44.71 1.44 Allowed Glycine 0 C--N 1.33 0.248 0 C-N-CA 120.824 -0.703 . . . . 0.0 112.586 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.819 ' O ' HG13 ' A' ' 40' ' ' VAL . 0.2 OUTLIER 58.36 -80.74 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 122.218 0.207 . . . . 0.0 111.402 179.767 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.869 ' O ' HG22 ' A' ' 40' ' ' VAL . 3.1 p 35.92 -145.71 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 CA-C-O 119.342 -0.361 . . . . 0.0 111.557 -179.829 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.869 HG22 ' O ' ' A' ' 39' ' ' VAL . 1.5 m 91.23 151.46 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 C-N-CA 123.482 0.713 . . . . 0.0 111.455 -179.641 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 167.15 137.6 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.111 -179.971 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.696 HD13 ' N ' ' A' ' 42' ' ' LEU . 0.0 OUTLIER -142.28 153.4 43.88 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.03 0.443 . . . . 0.0 111.301 -179.775 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.427 ' N ' ' HB2' ' A' ' 25' ' ' ARG . . . -159.78 12.23 0.18 Allowed Glycine 0 N--CA 1.45 -0.388 0 CA-C-N 115.833 -0.622 . . . . 0.0 112.736 179.782 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.434 ' O ' ' HB2' ' A' ' 45' ' ' ALA . 3.3 m 62.65 147.62 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.897 0.38 . . . . 0.0 111.333 179.249 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.769 ' HB3' ' CD1' ' A' ' 24' ' ' TYR . . . 175.97 137.3 0.05 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.769 179.345 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -70.27 67.96 0.33 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.051 0.453 . . . . 0.0 110.795 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.816 HG22 ' HD3' ' A' ' 49' ' ' PRO . 89.0 m -164.77 147.09 8.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.817 -179.62 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -131.6 67.3 79.79 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.899 179.928 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.816 ' HD3' HG22 ' A' ' 47' ' ' THR . 32.6 Cg_exo -60.94 -11.22 17.22 Favored 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 122.466 2.111 . . . . 0.0 111.659 178.943 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 32.4 t -39.33 -68.7 0.15 Allowed 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 115.598 -0.728 . . . . 0.0 112.336 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 16.6 ptmt -90.69 77.16 6.37 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 120.923 0.392 . . . . 0.0 111.718 -179.238 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.624 ' HB3' ' CD ' ' A' ' 53' ' ' PRO . 0.6 OUTLIER -148.34 -167.11 0.15 Allowed Pre-proline 0 CA--C 1.538 0.494 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 179.682 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 53' ' ' PRO . . . . . 0.624 ' CD ' ' HB3' ' A' ' 52' ' ' LYS . 76.0 Cg_exo -51.96 -142.33 0.0 OUTLIER 'Trans proline' 0 C--N 1.356 0.947 0 C-N-CA 122.445 2.097 . . . . 0.0 113.198 -179.461 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -75.71 106.97 7.56 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 120.83 0.347 . . . . 0.0 111.782 -179.059 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -144.19 -157.91 0.83 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.585 179.104 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.407 ' HG3' ' O ' ' A' ' 27' ' ' MET . 0.3 OUTLIER -161.25 26.82 0.13 Allowed 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.432 -179.985 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.624 HG11 ' CE2' ' A' ' 24' ' ' TYR . 1.9 t -107.54 170.78 2.41 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.5 179.438 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.569 ' H ' HG12 ' A' ' 57' ' ' VAL . 10.7 p -148.22 40.54 0.95 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.14 179.718 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' CYS . . . . . 0.565 ' O ' ' CB ' ' A' ' 60' ' ' CYS . 80.4 m 56.06 -116.51 1.02 Allowed 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.802 -179.316 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.565 ' CB ' ' O ' ' A' ' 59' ' ' CYS . 2.4 m 139.17 47.07 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.476 0.71 . . . . 0.0 109.889 179.401 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.466 ' CB ' ' HG ' ' A' ' 22' ' ' LEU . 79.3 p -115.73 160.55 19.94 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.334 -179.424 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 1.3 m 73.84 17.68 3.51 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.934 -0.576 . . . . 0.0 111.635 179.732 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.9 p30 171.18 167.93 0.08 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 120.687 0.28 . . . . 0.0 110.909 179.71 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.494 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 0.0 OUTLIER -56.96 -32.79 66.39 Favored 'General case' 0 CA--C 1.516 -0.352 0 CA-C-O 121.498 0.666 . . . . 0.0 110.913 179.827 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 65' ' ' CYS . . . . . 0.408 ' HB3' ' O ' ' A' ' 64' ' ' LYS . 43.6 t 72.32 -44.36 0.59 Allowed 'General case' 0 C--N 1.313 -0.986 0 CA-C-N 114.727 -1.124 . . . . 0.0 112.689 179.03 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.455 ' HB2' ' NE2' ' A' ' 4' ' ' HIS . 0.3 OUTLIER -40.07 97.35 0.13 Allowed Pre-proline 0 N--CA 1.47 0.543 0 CA-C-O 120.697 0.284 . . . . 0.0 111.532 -178.92 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 67' ' ' PRO . . . . . 0.459 ' O ' ' CG ' ' A' ' 68' ' ' HIS . 6.7 Cg_exo -73.88 -2.24 11.96 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.953 2.435 . . . . 0.0 112.711 -179.98 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.459 ' CG ' ' O ' ' A' ' 67' ' ' PRO . 3.4 p80 55.98 168.49 0.05 OUTLIER Pre-proline 0 CA--C 1.53 0.202 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.085 -179.824 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 77.2 Cg_exo -50.53 114.42 1.45 Allowed 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.531 2.154 . . . . 0.0 112.325 -179.869 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.447 ' O ' ' N ' ' A' ' 72' ' ' ARG . 2.3 mtmm -61.52 -61.68 2.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.948 -179.925 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.4 ' HA ' ' CD ' ' A' ' 38' ' ' LYS . 1.3 tt0 52.37 -85.72 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.349 179.745 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.447 ' N ' ' O ' ' A' ' 70' ' ' LYS . 2.1 mmp_? -57.54 154.31 25.17 Favored Pre-proline 0 C--N 1.331 -0.212 0 CA-C-O 120.645 0.259 . . . . 0.0 110.781 179.825 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -59.1 -24.1 72.09 Favored 'Trans proline' 0 C--N 1.343 0.289 0 C-N-CA 122.594 2.196 . . . . 0.0 112.132 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.386 -1.23 . . . . 0.0 112.463 179.896 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 181' ' ' TYR . . . . . . . . . . . . . 47.0 m-85 . . . . . 0 N--CA 1.486 1.341 0 CA-C-O 120.844 0.354 . . . . 0.0 111.197 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 182' ' ' ARG . . . . . . . . . . . . . 8.3 ttt85 62.62 148.0 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.929 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 183' ' ' GLY . . . . . 0.463 ' O ' ' CG ' ' B' ' 184' ' ' TRP . . . -79.43 -18.22 74.22 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.636 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 184' ' ' TRP . . . . . 0.463 ' CG ' ' O ' ' B' ' 183' ' ' GLY . 6.6 p90 46.1 -172.97 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 120.848 0.356 . . . . 0.0 111.529 -179.879 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 185' ' ' LYS . . . . . . . . . . . . . 23.9 ttpp -92.73 128.91 38.76 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.051 -179.484 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 186' ' ' HIS . . . . . . . . . . . . . 7.5 p80 -87.79 -172.49 3.88 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.722 179.745 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 187' ' ' TRP . . . . . . . . . . . . . 9.5 m95 -90.16 155.04 19.31 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.009 0.433 . . . . 0.0 111.27 -179.75 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 188' ' ' VAL . . . . . 0.707 HG21 ' CZ ' ' B' ' 190' ' ' TYR . 0.2 OUTLIER -86.97 -152.57 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.161 179.488 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 189' ' ' TYR . . . . . . . . . . . . . 35.9 m-85 -97.55 31.71 2.49 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 120.93 0.395 . . . . 0.0 110.232 179.549 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 190' ' ' TYR . . . . . 0.707 ' CZ ' HG21 ' B' ' 188' ' ' VAL . 3.7 m-30 -79.48 112.19 16.48 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.919 -179.641 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 191' ' ' THR . . . . . . . . . . . . . 86.4 m -74.98 113.73 12.63 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.465 179.55 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 192' ' ' CYS . . . . . 0.687 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.0 OUTLIER -85.91 170.66 12.13 Favored 'General case' 0 CA--C 1.496 -1.113 0 CA-C-O 121.955 0.883 . . . . 0.0 111.352 -179.8 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 193' ' ' CYS . . . . . 0.687 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.1 OUTLIER 40.02 89.53 0.08 OUTLIER Pre-proline 0 N--CA 1.439 -0.983 0 CA-C-N 113.23 -1.805 . . . . 0.0 112.257 173.774 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 194' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_exo -49.07 176.93 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.61 2.206 . . . . 0.0 112.375 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 195' ' ' ASP . . . . . 0.427 ' HA ' ' HG3' ' A' ' 10' ' ' PRO . 11.1 p-10 -65.55 76.27 0.07 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.121 -179.882 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 196' ' ' THR . . . . . 0.697 ' N ' ' HD3' ' B' ' 197' ' ' PRO . 9.7 t -150.14 45.56 0.36 Allowed Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.934 179.862 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 197' ' ' PRO . . . . . 0.697 ' HD3' ' N ' ' B' ' 196' ' ' THR . 3.7 Cg_exo -76.27 13.55 1.3 Allowed 'Trans proline' 0 C--N 1.351 0.68 0 C-N-CA 121.797 1.665 . . . . 0.0 108.572 175.894 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 198' ' ' TYR . . . . . 0.556 ' H ' ' C ' ' B' ' 196' ' ' THR . 43.6 t80 . . . . . 0 C--O 1.249 1.075 0 CA-C-N 113.766 -1.561 . . . . 0.0 111.237 -178.81 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 2.8 pp . . . . . 0 N--CA 1.486 1.369 0 CA-C-O 120.789 0.328 . . . . 0.0 111.143 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 0.648 ' CG1' HG22 ' A' ' 15' ' ' THR . 22.5 t -144.91 148.46 17.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.55 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -97.31 -156.79 0.55 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.776 179.81 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' HIS . . . . . 0.508 ' CD2' ' HA ' ' A' ' 64' ' ' LYS . 2.2 p80 -123.89 151.25 43.71 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 178.745 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.917 HG22 ' HA ' ' A' ' 13' ' ' ALA . 42.9 p -60.14 114.17 2.73 Favored 'General case' 0 N--CA 1.439 -0.979 0 CA-C-O 121.554 0.692 . . . . 0.0 111.974 -178.43 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.598 HG22 ' O ' ' A' ' 6' ' ' THR . 64.5 m -151.39 27.95 0.65 Allowed 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 114.706 -1.134 . . . . 0.0 108.835 178.944 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.725 ' HB3' ' CB ' ' A' ' 12' ' ' SER . . . -39.31 -31.7 0.09 Allowed 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 115.346 -0.843 . . . . 0.0 112.357 -179.146 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 88.1 m -125.23 -72.69 0.66 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.78 0.324 . . . . 0.0 111.209 -179.796 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.528 ' CB ' ' CD ' ' A' ' 10' ' ' PRO . 0.4 OUTLIER -146.89 -69.81 0.02 OUTLIER Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.77 179.875 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.656 ' HB2' HD13 ' A' ' 11' ' ' ILE . 30.5 Cg_endo -63.89 -85.92 0.01 OUTLIER 'Trans proline' 0 C--N 1.348 0.525 0 C-N-CA 121.904 1.736 . . . . 0.0 111.759 179.614 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.656 HD13 ' HB2' ' A' ' 10' ' ' PRO . 0.0 OUTLIER -147.82 149.61 15.22 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.149 0 CA-C-O 120.679 0.275 . . . . 0.0 110.728 179.404 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.757 ' H ' ' HB ' ' A' ' 5' ' ' THR . 0.4 OUTLIER -159.65 -88.15 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 179.936 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.917 ' HA ' HG22 ' A' ' 5' ' ' THR . . . -179.97 124.37 0.07 Allowed 'General case' 0 CA--C 1.529 0.148 0 CA-C-O 120.755 0.312 . . . . 0.0 111.624 -179.84 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.462 HG21 ' O ' ' A' ' 4' ' ' HIS . 0.2 OUTLIER -120.3 -99.62 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.089 179.706 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.648 HG22 ' CG1' ' A' ' 2' ' ' VAL . 26.9 p 53.65 173.54 0.02 OUTLIER 'General case' 0 C--O 1.231 0.127 0 CA-C-O 121.076 0.465 . . . . 0.0 111.765 179.697 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.0 t -169.94 135.83 1.28 Allowed Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.151 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_endo -46.25 139.55 12.1 Favored 'Trans proline' 0 C--N 1.348 0.5 0 C-N-CA 122.706 2.271 . . . . 0.0 112.471 -179.717 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_exo -48.78 162.25 0.4 Allowed 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.612 2.208 . . . . 0.0 112.28 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 62.69 124.15 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.621 -0.799 . . . . 0.0 112.175 -179.782 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER 61.33 59.57 1.9 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.107 0.48 . . . . 0.0 110.655 -179.809 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 16.5 p-10 -155.29 96.05 1.77 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.53 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.409 ' O ' ' N ' ' A' ' 61' ' ' SER . 59.2 mt -112.79 28.16 9.02 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.615 -179.493 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.561 ' O ' ' HB3' ' A' ' 60' ' ' CYS . 7.8 t 37.08 67.44 0.35 Allowed 'General case' 0 C--O 1.222 -0.373 0 CA-C-N 116.6 -0.273 . . . . 0.0 111.608 179.331 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.85 ' CD2' ' HB2' ' A' ' 45' ' ' ALA . 0.0 OUTLIER -84.25 170.49 13.66 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 121.204 0.526 . . . . 0.0 112.366 -179.002 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.498 ' HB2' ' O ' ' A' ' 42' ' ' LEU . 0.0 OUTLIER 174.57 150.75 0.09 Allowed 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.477 -179.67 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.584 ' O ' ' CB ' ' A' ' 27' ' ' MET . 0.1 OUTLIER -144.83 -83.48 0.14 Allowed 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 120.765 -0.374 . . . . 0.0 111.821 179.996 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 27' ' ' MET . . . . . 0.584 ' CB ' ' O ' ' A' ' 26' ' ' LYS . 5.7 ptt? 134.09 -144.84 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.989 0.916 . . . . 0.0 108.692 -179.155 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' TRP . . . . . 0.762 ' HB3' HG21 ' A' ' 39' ' ' VAL . 0.0 OUTLIER -169.9 170.46 7.71 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-O 120.71 0.29 . . . . 0.0 110.892 179.179 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 18.4 t -177.38 -77.05 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.919 179.859 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 170.41 -80.76 0.0 OUTLIER 'General case' 0 CA--C 1.529 0.17 0 CA-C-O 120.676 0.274 . . . . 0.0 110.992 179.875 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -161.97 -80.98 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.189 179.937 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 35.2 p90 -97.5 21.05 10.73 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.777 0.322 . . . . 0.0 111.087 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 2.3 p -75.51 125.28 28.71 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.0 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 5.5 m -62.92 -20.81 65.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.232 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 25.7 p -87.38 50.88 2.09 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.884 0.373 . . . . 0.0 111.013 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 4.6 ptt85 -67.04 81.87 0.12 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.97 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.439 ' HA3' ' HG2' ' A' ' 70' ' ' LYS . . . 163.31 -142.18 7.68 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.678 -0.773 . . . . 0.0 112.6 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.435 ' HD2' ' CD ' ' A' ' 70' ' ' LYS . 0.0 OUTLIER 65.93 -63.59 0.22 Allowed 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.523 0.202 . . . . 0.0 111.061 -179.745 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.884 HG13 ' HB3' ' B' ' 189' ' ' TYR . 2.3 t -54.72 106.97 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 121.079 0.466 . . . . 0.0 110.049 179.521 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.507 HG13 ' CG ' ' A' ' 69' ' ' PRO . 0.1 OUTLIER -39.62 155.82 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 N-CA-C 113.265 0.839 . . . . 0.0 113.265 -178.152 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.422 ' HG2' ' HG2' ' A' ' 25' ' ' ARG . 2.0 mp0 -100.32 -164.08 1.08 Allowed 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 114.51 -1.223 . . . . 0.0 111.206 -179.163 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.829 HD13 ' OH ' ' A' ' 24' ' ' TYR . 2.8 mt -120.52 -163.96 1.06 Allowed 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.659 -179.815 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.454 ' HA2' ' O ' ' A' ' 24' ' ' TYR . . . -160.43 123.97 1.28 Allowed Glycine 0 C--N 1.335 0.482 0 C-N-CA 120.329 -0.939 . . . . 0.0 113.73 -179.104 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.478 ' O ' ' CE1' ' A' ' 24' ' ' TYR . 0.5 OUTLIER 59.59 129.06 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 112.392 0.516 . . . . 0.0 112.392 179.075 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.85 ' HB2' ' CD2' ' A' ' 24' ' ' TYR . . . -140.73 -164.27 1.7 Allowed 'General case' 0 N--CA 1.461 0.103 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.176 179.921 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -132.04 20.32 4.51 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.602 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.466 HG23 ' HG2' ' A' ' 49' ' ' PRO . 1.5 m -178.58 124.07 0.1 Allowed 'General case' 0 CA--C 1.53 0.194 0 CA-C-O 120.777 0.322 . . . . 0.0 110.89 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.639 ' O ' ' N ' ' A' ' 50' ' ' SER . 47.5 t -77.83 -55.92 1.16 Allowed Pre-proline 0 C--N 1.332 -0.186 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.813 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.524 ' HD2' ' N ' ' A' ' 48' ' ' CYS . 4.0 Cg_exo -40.22 81.76 0.01 OUTLIER 'Trans proline' 0 C--N 1.356 0.967 0 C-N-CA 122.627 2.218 . . . . 0.0 111.411 179.842 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.639 ' N ' ' O ' ' A' ' 48' ' ' CYS . 41.1 t -131.25 8.31 4.68 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.296 -0.865 . . . . 0.0 111.541 -178.083 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 8.9 mtmt -61.93 -19.2 62.46 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.236 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.575 ' HB3' ' HD2' ' A' ' 53' ' ' PRO . 0.0 OUTLIER -57.15 179.64 0.13 Allowed Pre-proline 0 C--N 1.331 -0.227 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.311 179.894 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 53' ' ' PRO . . . . . 0.575 ' HD2' ' HB3' ' A' ' 52' ' ' LYS . 97.8 Cg_exo -45.14 -45.72 14.3 Favored 'Trans proline' 0 C--N 1.349 0.587 0 C-N-CA 122.353 2.036 . . . . 0.0 112.484 -179.833 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' TYR . . . . . 0.476 ' CE2' ' HB2' ' A' ' 52' ' ' LYS . 0.0 OUTLIER -69.61 65.47 0.2 Allowed 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 121.065 0.459 . . . . 0.0 110.63 179.705 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -82.16 -145.33 0.06 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.641 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.814 ' O ' HG13 ' A' ' 57' ' ' VAL . 15.9 tt0 76.22 20.95 1.52 Allowed 'General case' 0 CA--C 1.524 -0.046 0 CA-C-O 120.546 0.213 . . . . 0.0 110.813 -179.593 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.814 HG13 ' O ' ' A' ' 56' ' ' GLU . 0.0 OUTLIER 178.72 141.83 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.462 0.167 0 CA-C-O 121.064 0.459 . . . . 0.0 111.503 179.409 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 11.5 t -157.93 140.51 14.63 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.313 179.753 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 31.8 p -45.94 123.57 4.63 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 120.989 0.423 . . . . 0.0 111.381 -179.497 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.561 ' HB3' ' O ' ' A' ' 23' ' ' CYS . 0.1 OUTLIER -131.25 44.55 2.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.423 -179.707 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.409 ' N ' ' O ' ' A' ' 22' ' ' LEU . 8.8 p -80.81 132.2 35.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.355 -179.41 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.588 HG22 ' N ' ' A' ' 63' ' ' ASP . 1.2 m 177.21 -74.4 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.159 179.811 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ASP . . . . . 0.588 ' N ' HG22 ' A' ' 62' ' ' THR . 67.9 t0 179.99 -37.76 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.595 179.846 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.508 ' HA ' ' CD2' ' A' ' 4' ' ' HIS . 1.5 mtpt -131.1 79.09 1.87 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.607 179.83 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' CYS . . . . . 0.461 ' HB3' ' HB3' ' A' ' 60' ' ' CYS . 0.0 OUTLIER -137.98 7.0 2.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.875 -179.718 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.506 ' HB2' ' HD2' ' A' ' 67' ' ' PRO . 0.1 OUTLIER -57.61 166.63 1.68 Allowed Pre-proline 0 N--CA 1.462 0.162 0 CA-C-O 120.493 0.187 . . . . 0.0 110.695 -179.991 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 67' ' ' PRO . . . . . 0.506 ' HD2' ' HB2' ' A' ' 66' ' ' ASN . 88.6 Cg_exo -44.72 162.96 0.07 OUTLIER 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.409 2.073 . . . . 0.0 112.161 179.688 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -176.24 64.05 0.22 Allowed Pre-proline 0 C--N 1.326 -0.427 0 CA-C-O 120.894 0.378 . . . . 0.0 111.068 -179.605 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.507 ' CG ' HG13 ' A' ' 40' ' ' VAL . 77.8 Cg_exo -49.57 129.59 23.75 Favored 'Trans proline' 0 C--N 1.344 0.31 0 C-N-CA 122.594 2.196 . . . . 0.0 111.751 179.556 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.503 ' O ' ' C ' ' A' ' 71' ' ' GLN . 0.4 OUTLIER -69.94 -47.25 63.12 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 120.836 -0.346 . . . . 0.0 111.564 -179.231 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.503 ' C ' ' O ' ' A' ' 70' ' ' LYS . 2.2 tt0 19.79 53.53 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 179.743 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.43 ' N ' ' O ' ' A' ' 70' ' ' LYS . 0.1 OUTLIER -79.8 132.63 60.43 Favored Pre-proline 0 C--N 1.33 -0.241 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.014 -179.509 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -77.9 -167.77 0.52 Allowed 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 122.554 2.169 . . . . 0.0 112.418 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.097 0 CA-C-O 118.398 -1.223 . . . . 0.0 112.582 180.0 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 181' ' ' TYR . . . . . . . . . . . . . 10.4 t80 . . . . . 0 N--CA 1.486 1.374 0 CA-C-O 120.859 0.362 . . . . 0.0 111.279 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 182' ' ' ARG . . . . . . . . . . . . . 11.5 tpt180 -57.86 136.56 57.02 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.984 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 183' ' ' GLY . . . . . . . . . . . . . . . -53.21 103.08 0.12 Allowed Glycine 0 CA--C 1.518 0.266 0 C-N-CA 120.847 -0.692 . . . . 0.0 112.708 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 184' ' ' TRP . . . . . . . . . . . . . 21.3 p90 -100.69 151.43 21.66 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.732 0.301 . . . . 0.0 110.893 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 185' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -177.42 141.24 0.3 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.952 179.926 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 186' ' ' HIS . . . . . . . . . . . . . 9.2 p80 -79.94 63.49 4.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.812 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 187' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -57.22 -68.17 0.25 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.013 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 2.3 p -82.67 125.28 39.93 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.314 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.925 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 189' ' ' TYR . . . . . 0.884 ' HB3' HG13 ' A' ' 39' ' ' VAL . 0.1 OUTLIER -84.26 133.51 34.56 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.418 179.894 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 190' ' ' TYR . . . . . . . . . . . . . 44.9 t80 -160.04 135.94 8.53 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.294 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 191' ' ' THR . . . . . 0.452 ' HB ' ' HG2' ' A' ' 69' ' ' PRO . 14.5 t -33.12 141.32 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 115.876 -0.602 . . . . 0.0 112.145 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 192' ' ' CYS . . . . . 0.685 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.1 OUTLIER -90.33 169.5 11.05 Favored 'General case' 0 CA--C 1.499 -0.993 0 CA-C-O 122.252 1.025 . . . . 0.0 111.972 -179.759 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 193' ' ' CYS . . . . . 0.685 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.1 OUTLIER 36.27 92.71 0.05 OUTLIER Pre-proline 0 C--N 1.314 -0.955 0 CA-C-N 112.795 -2.002 . . . . 0.0 113.119 173.394 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 194' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -59.27 145.03 99.1 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.592 2.195 . . . . 0.0 112.042 179.549 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 78.6 m-20 -131.35 12.17 5.0 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.515 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 196' ' ' THR . . . . . 0.59 ' N ' ' CD ' ' B' ' 197' ' ' PRO . 0.2 OUTLIER -122.26 35.4 0.26 Allowed Pre-proline 0 C--N 1.33 -0.27 0 N-CA-C 112.096 0.406 . . . . 0.0 112.096 179.873 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 197' ' ' PRO . . . . . 0.59 ' CD ' ' N ' ' B' ' 196' ' ' THR . 77.9 Cg_endo -74.73 15.7 0.68 Allowed 'Trans proline' 0 C--N 1.35 0.638 0 C-N-CA 121.551 1.501 . . . . 0.0 108.967 176.203 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 198' ' ' TYR . . . . . 0.589 ' H ' ' C ' ' B' ' 196' ' ' THR . 7.9 t80 . . . . . 0 C--O 1.249 1.028 0 CA-C-N 114.033 -1.44 . . . . 0.0 111.25 -178.741 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' ILE . . . . . 0.574 HG23 ' O ' ' A' ' 62' ' ' THR . 5.1 mp . . . . . 0 N--CA 1.485 1.322 0 CA-C-O 120.421 0.153 . . . . 0.0 111.13 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 0.659 ' HB ' HG22 ' A' ' 15' ' ' THR . 33.3 m 45.82 -179.34 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.312 0 CA-C-O 120.897 0.379 . . . . 0.0 111.865 -179.788 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 55.9 m -128.78 -139.76 0.24 Allowed 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.999 -179.165 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' HIS . . . . . 0.952 ' O ' HG22 ' A' ' 14' ' ' VAL . 0.3 OUTLIER -109.48 -95.77 0.4 Allowed 'General case' 0 CA--C 1.53 0.188 0 O-C-N 122.406 -0.184 . . . . 0.0 110.53 179.926 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.767 ' HA ' HG13 ' A' ' 14' ' ' VAL . 2.3 t -145.13 145.66 31.48 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.974 0.416 . . . . 0.0 110.916 179.396 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.839 HG21 ' HA2' ' A' ' 43' ' ' GLY . 9.6 p -103.19 77.92 1.58 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.892 -179.81 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.498 ' O ' HG23 ' A' ' 8' ' ' THR . . . -177.96 -68.67 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.174 -179.875 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.498 HG23 ' O ' ' A' ' 7' ' ' ALA . 0.6 OUTLIER -162.91 147.16 11.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.797 -179.817 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.602 ' H ' HG23 ' B' ' 191' ' ' THR . 0.4 OUTLIER 57.97 174.55 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.959 179.98 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -80.17 -88.37 0.0 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.51 0 C-N-CA 122.487 2.125 . . . . 0.0 111.842 179.671 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.461 ' O ' ' CB ' ' A' ' 12' ' ' SER . 1.2 mp 70.34 -57.72 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.16 0 N-CA-C 112.203 0.446 . . . . 0.0 112.203 179.134 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.467 ' HA ' ' HA ' ' A' ' 4' ' ' HIS . 1.2 m 84.58 111.44 0.05 Allowed 'General case' 0 N--CA 1.464 0.225 0 CA-C-O 120.835 0.35 . . . . 0.0 110.511 -179.104 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -163.81 -31.8 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.695 -179.597 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.952 HG22 ' O ' ' A' ' 4' ' ' HIS . 2.0 m -41.11 -86.59 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.354 0 N-CA-C 111.478 0.177 . . . . 0.0 111.478 -179.727 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.826 ' H ' HG23 ' A' ' 14' ' ' VAL . 26.2 p 51.07 104.63 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.904 0.383 . . . . 0.0 111.9 179.423 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.658 ' N ' ' HD3' ' A' ' 17' ' ' PRO . 28.3 p -138.87 49.67 2.36 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.021 178.668 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.658 ' HD3' ' N ' ' A' ' 16' ' ' CYS . 35.6 Cg_exo -60.29 -44.87 25.62 Favored 'Trans proline' 0 C--N 1.353 0.783 0 C-N-CA 122.675 2.25 . . . . 0.0 113.42 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.488 ' HD2' ' N ' ' A' ' 17' ' ' PRO . 37.3 Cg_exo -38.2 -44.08 1.88 Allowed 'Trans proline' 0 C--N 1.349 0.593 0 C-N-CA 122.918 2.412 . . . . 0.0 113.401 -179.259 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -107.93 -136.22 7.89 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.476 -0.868 . . . . 0.0 113.143 -179.692 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.562 ' CB ' ' HA ' ' A' ' 46' ' ' ALA . 0.3 OUTLIER -35.71 -42.94 0.27 Allowed 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 112.937 0.717 . . . . 0.0 112.937 -179.347 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.416 ' N ' ' HG2' ' A' ' 20' ' ' GLU . 0.1 OUTLIER 79.19 -52.52 0.44 Allowed 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 114.845 -1.07 . . . . 0.0 110.926 -179.398 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.783 ' O ' ' HA ' ' A' ' 44' ' ' CYS . 0.4 OUTLIER -59.72 118.25 5.93 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 179.368 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.565 ' HA ' ' HA ' ' A' ' 44' ' ' CYS . 6.0 m -80.44 39.7 0.47 Allowed 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 113.091 0.775 . . . . 0.0 113.091 -178.514 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.541 ' CG ' ' HB2' ' A' ' 45' ' ' ALA . 0.1 OUTLIER 43.67 -165.58 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.375 0 CA-C-O 120.71 0.29 . . . . 0.0 111.204 179.55 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.543 ' CB ' HG23 ' A' ' 58' ' ' THR . 0.1 OUTLIER -179.97 90.2 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.979 -0.288 . . . . 0.0 111.615 179.717 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.732 ' HG2' HG13 ' A' ' 57' ' ' VAL . 4.8 mtmt -84.09 110.82 18.78 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.796 179.538 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 1.6 ttp -131.03 92.2 3.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.312 -179.803 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' TRP . . . . . 0.631 ' HB2' HG11 ' A' ' 39' ' ' VAL . 0.0 OUTLIER -67.12 -159.81 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.409 179.574 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 93.5 m -148.94 157.54 43.5 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.852 0.358 . . . . 0.0 110.986 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -137.71 121.02 16.97 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.676 179.905 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.427 ' C ' ' CG ' ' A' ' 32' ' ' PHE . . . 62.22 90.39 0.07 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.814 -179.717 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.427 ' CG ' ' C ' ' A' ' 31' ' ' ALA . 4.6 p90 44.48 30.11 0.46 Allowed 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.361 -179.79 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 9.2 t 43.55 55.75 4.78 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.37 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -156.74 28.38 0.32 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.657 179.803 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.429 ' O ' ' C ' ' A' ' 36' ' ' ARG . 43.2 m -138.24 37.86 2.3 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.585 -179.891 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.446 ' HG3' ' HB2' ' A' ' 70' ' ' LYS . 0.2 OUTLIER 25.84 89.77 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 115.739 -0.664 . . . . 0.0 112.275 179.55 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.44 ' N ' ' HG3' ' A' ' 70' ' ' LYS . . . -80.06 -127.33 0.66 Allowed Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.639 -0.791 . . . . 0.0 113.315 -179.557 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.429 ' O ' ' HB3' ' B' ' 190' ' ' TYR . 0.0 OUTLIER -173.46 99.89 0.12 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.947 0.404 . . . . 0.0 110.211 -179.302 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.631 HG11 ' HB2' ' A' ' 28' ' ' TRP . 58.7 t -155.89 139.94 8.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.578 179.942 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.622 HG23 HD21 ' A' ' 42' ' ' LEU . 7.1 p -161.56 159.89 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.869 -179.47 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.52 ' C ' ' HG ' ' A' ' 42' ' ' LEU . 13.9 tp10 -173.32 -58.36 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.379 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.622 HD21 HG23 ' A' ' 40' ' ' VAL . 0.0 OUTLIER 44.12 -168.82 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.861 -179.348 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.839 ' HA2' HG21 ' A' ' 6' ' ' THR . . . 141.58 37.64 0.09 OUTLIER Glycine 0 C--N 1.328 0.102 0 C-N-CA 120.157 -1.021 . . . . 0.0 113.678 179.447 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.783 ' HA ' ' O ' ' A' ' 22' ' ' LEU . 59.2 m 61.99 141.26 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.887 0.344 . . . . 0.0 111.348 179.191 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.541 ' HB2' ' CG ' ' A' ' 24' ' ' TYR . . . -130.0 -99.57 0.33 Allowed 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 112.042 0.386 . . . . 0.0 112.042 -179.557 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.562 ' HA ' ' CB ' ' A' ' 20' ' ' GLU . . . -179.33 -41.4 0.01 OUTLIER 'General case' 0 C--O 1.23 0.057 0 CA-C-O 120.906 0.384 . . . . 0.0 110.958 -179.368 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 4.7 t -178.12 45.65 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.118 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.462 ' N ' ' HD3' ' A' ' 49' ' ' PRO . 10.1 m 55.68 62.9 6.78 Favored Pre-proline 0 C--N 1.332 -0.195 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.374 179.733 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.462 ' HD3' ' N ' ' A' ' 48' ' ' CYS . 5.4 Cg_exo -76.47 3.9 5.96 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.755 2.303 . . . . 0.0 111.502 178.862 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.478 ' O ' ' HB2' ' A' ' 51' ' ' LYS . 30.3 t -51.05 -62.55 1.55 Allowed 'General case' 0 N--CA 1.455 -0.195 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.519 -179.804 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.478 ' HB2' ' O ' ' A' ' 50' ' ' SER . 9.5 mtpt 77.87 -50.28 0.5 Allowed 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.483 -179.729 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.36 133.16 20.72 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.003 -179.739 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' PRO . . . . . 0.401 ' HG2' ' CE1' ' A' ' 54' ' ' TYR . 69.2 Cg_endo -76.16 -47.94 0.15 Allowed 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.534 2.156 . . . . 0.0 112.612 -179.855 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' TYR . . . . . 0.404 ' O ' ' CZ3' ' A' ' 28' ' ' TRP . 0.0 OUTLIER -51.94 -25.94 9.32 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.101 -179.911 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -55.56 -85.36 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.94 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 167.33 -74.92 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 120.945 0.402 . . . . 0.0 110.971 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.732 HG13 ' HG2' ' A' ' 26' ' ' LYS . 2.8 m -50.54 154.37 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 115.899 -0.592 . . . . 0.0 111.924 -179.615 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.543 HG23 ' CB ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -164.1 -95.25 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.992 179.648 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -151.11 160.15 44.06 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 120.94 0.4 . . . . 0.0 111.315 -179.699 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.501 ' HB2' ' O ' ' A' ' 24' ' ' TYR . 0.1 OUTLIER -138.7 -18.59 1.07 Allowed 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.609 179.846 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.657 ' O ' HG23 ' A' ' 62' ' ' THR . 83.1 p -42.8 106.33 0.06 Allowed 'General case' 0 N--CA 1.462 0.17 0 CA-C-O 120.843 0.354 . . . . 0.0 111.859 -179.503 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.657 HG23 ' O ' ' A' ' 61' ' ' SER . 4.0 p -164.84 -76.45 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.601 179.646 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 30.6 p-10 177.58 -39.31 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.704 179.821 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -160.81 56.52 0.31 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.998 -0.547 . . . . 0.0 110.486 179.712 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' CYS . . . . . 0.426 ' O ' ' C ' ' A' ' 66' ' ' ASN . 1.3 p -55.12 -62.73 1.47 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.366 -179.499 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.426 ' C ' ' O ' ' A' ' 65' ' ' CYS . 1.3 p-10 29.69 62.02 0.86 Allowed Pre-proline 0 N--CA 1.468 0.466 0 C-N-CA 122.625 0.37 . . . . 0.0 111.962 -179.78 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' PRO . . . . . 0.417 ' HG2' ' HG2' ' A' ' 25' ' ' ARG . 54.0 Cg_exo -52.35 -57.21 2.24 Favored 'Trans proline' 0 C--N 1.343 0.274 0 C-N-CA 122.651 2.234 . . . . 0.0 112.8 -179.631 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.468 ' HB3' ' HD2' ' A' ' 69' ' ' PRO . 15.7 m170 62.34 161.01 0.12 Allowed Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.349 -179.671 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.468 ' HD2' ' HB3' ' A' ' 68' ' ' HIS . 67.7 Cg_exo -36.23 126.07 0.37 Allowed 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 123.046 2.497 . . . . 0.0 112.791 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.446 ' HB2' ' HG3' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -57.44 -16.9 10.68 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.288 -179.977 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.51 64.54 0.18 Allowed 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.969 0.414 . . . . 0.0 110.736 179.652 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.713 ' N ' ' HD2' ' A' ' 73' ' ' PRO . 5.3 ptp180 -60.11 -42.5 90.22 Favored Pre-proline 0 CA--C 1.534 0.353 0 N-CA-C 112.423 0.527 . . . . 0.0 112.423 -179.705 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.713 ' HD2' ' N ' ' A' ' 72' ' ' ARG . 5.0 Cg_endo -47.14 -26.89 5.73 Favored 'Trans proline' 0 C--N 1.352 0.721 0 C-N-CA 122.309 2.006 . . . . 0.0 112.513 -179.695 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.387 -1.229 . . . . 0.0 112.445 179.858 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 181' ' ' TYR . . . . . . . . . . . . . 17.8 m-85 . . . . . 0 N--CA 1.486 1.351 0 CA-C-O 120.814 0.34 . . . . 0.0 111.134 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 182' ' ' ARG . . . . . . . . . . . . . 13.6 ttt-85 60.86 156.39 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.912 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 183' ' ' GLY . . . . . . . . . . . . . . . 64.99 72.42 0.72 Allowed Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.406 -179.844 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 184' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -78.69 -2.8 40.95 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.561 0.219 . . . . 0.0 111.409 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 185' ' ' LYS . . . . . . . . . . . . . 3.5 tttp 63.7 137.41 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.115 0 CA-C-O 120.859 0.361 . . . . 0.0 110.957 179.875 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 186' ' ' HIS . . . . . . . . . . . . . 8.4 t60 -90.11 164.54 14.43 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.754 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 187' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -78.61 -176.36 4.81 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.832 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 188' ' ' VAL . . . . . 0.472 HG12 ' H ' ' B' ' 189' ' ' TYR . 0.2 OUTLIER -80.12 -172.7 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.675 179.712 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 189' ' ' TYR . . . . . 0.472 ' H ' HG12 ' B' ' 188' ' ' VAL . 3.2 m-85 -95.78 56.2 1.71 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.69 179.897 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 190' ' ' TYR . . . . . 0.464 ' CZ ' ' HA ' ' B' ' 192' ' ' CYS . 1.2 p90 -108.3 149.46 28.62 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.234 -179.678 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 191' ' ' THR . . . . . 0.602 HG23 ' H ' ' A' ' 9' ' ' SER . 24.2 m -62.19 86.63 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.022 0.439 . . . . 0.0 110.487 179.502 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 192' ' ' CYS . . . . . 0.7 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.5 OUTLIER -35.95 -54.37 0.76 Allowed 'General case' 0 CA--C 1.501 -0.939 0 CA-C-O 121.965 0.888 . . . . 0.0 112.296 -179.603 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 193' ' ' CYS . . . . . 0.7 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.0 OUTLIER -150.28 107.73 3.17 Favored Pre-proline 0 N--CA 1.434 -1.227 0 CA-C-N 113.492 -1.685 . . . . 0.0 111.903 -173.736 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 194' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -76.36 178.47 7.49 Favored 'Trans proline' 0 C--N 1.348 0.522 0 C-N-CA 122.545 2.163 . . . . 0.0 112.054 179.735 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 195' ' ' ASP . . . . . 0.414 ' C ' ' HD3' ' B' ' 197' ' ' PRO . 4.8 t0 55.06 100.18 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.916 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 196' ' ' THR . . . . . 0.754 ' N ' ' HD3' ' B' ' 197' ' ' PRO . 1.8 t -112.08 20.57 0.07 OUTLIER Pre-proline 0 CA--C 1.533 0.293 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 -179.783 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 197' ' ' PRO . . . . . 0.754 ' HD3' ' N ' ' B' ' 196' ' ' THR . 6.6 Cg_exo -68.52 19.43 0.14 Allowed 'Trans proline' 0 C--N 1.358 1.068 0 CA-C-N 120.382 1.172 . . . . 0.0 109.6 176.302 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 198' ' ' TYR . . . . . 0.679 ' H ' ' C ' ' B' ' 196' ' ' THR . 64.9 t80 . . . . . 0 C--O 1.249 1.046 0 CA-C-N 114.535 -1.211 . . . . 0.0 111.248 -178.828 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' ILE . . . . . 0.837 HG22 ' HB2' ' A' ' 63' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.445 0 CA-C-O 120.827 0.346 . . . . 0.0 110.989 . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 0.736 ' CG1' HG13 ' A' ' 14' ' ' VAL . 48.9 t -125.7 133.27 69.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.796 179.629 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.982 ' O ' HG21 ' A' ' 14' ' ' VAL . 19.4 m -92.33 65.22 4.53 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -178.545 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' HIS . . . . . 0.517 ' C ' ' O ' ' A' ' 3' ' ' CYS . 1.8 m-70 -10.49 93.03 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 112.651 0.611 . . . . 0.0 112.651 179.596 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.753 HG21 ' HB3' ' A' ' 9' ' ' SER . 0.0 OUTLIER 39.24 -166.07 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 115.951 -0.568 . . . . 0.0 112.042 179.492 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.601 ' O ' ' HB3' ' A' ' 7' ' ' ALA . 3.9 t -99.25 23.31 9.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.712 179.836 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.601 ' HB3' ' O ' ' A' ' 6' ' ' THR . . . 86.87 -31.3 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.624 -179.847 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.695 ' OG1' HG22 ' B' ' 191' ' ' THR . 0.2 OUTLIER -67.08 -27.76 67.63 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.673 0.273 . . . . 0.0 111.149 -179.824 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.753 ' HB3' HG21 ' A' ' 5' ' ' THR . 5.7 t -123.36 152.02 63.68 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.916 -179.911 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_endo -64.41 -48.46 4.51 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.437 2.091 . . . . 0.0 112.33 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 12.9 tt -178.62 144.37 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.158 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 17.6 t -157.58 -81.23 0.06 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.201 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -152.76 57.02 0.8 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.961 0.41 . . . . 0.0 110.761 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.982 HG21 ' O ' ' A' ' 3' ' ' CYS . 2.8 p -74.81 -107.22 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.083 -179.451 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.722 ' H ' HG13 ' A' ' 14' ' ' VAL . 3.3 p 62.26 144.8 0.02 OUTLIER 'General case' 0 CA--C 1.522 -0.118 0 CA-C-O 120.944 0.402 . . . . 0.0 110.895 -179.956 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.508 ' HB3' ' CD ' ' A' ' 17' ' ' PRO . 0.1 OUTLIER -148.02 -65.41 0.02 OUTLIER Pre-proline 0 C--N 1.326 -0.449 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.607 -179.834 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.67 ' HB2' HD12 ' A' ' 1' ' ' ILE . 9.2 Cg_endo -52.09 100.1 0.05 OUTLIER 'Trans proline' 0 C--N 1.348 0.545 0 C-N-CA 122.62 2.213 . . . . 0.0 112.861 -179.633 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.404 ' CD ' ' HB2' ' A' ' 21' ' ' ASN . 1.9 Cg_endo -82.16 -57.83 0.03 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.55 0 C-N-CA 122.993 2.462 . . . . 0.0 111.451 179.494 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -124.98 -40.81 0.4 Allowed Glycine 0 N--CA 1.45 -0.421 0 CA-C-N 115.836 -0.62 . . . . 0.0 112.009 179.559 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 24.9 tp10 -160.11 68.33 0.38 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.897 0.38 . . . . 0.0 110.83 179.86 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.404 ' HB2' ' CD ' ' A' ' 18' ' ' PRO . 2.9 m-80 -140.95 83.51 1.89 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.045 -179.856 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.833 HD13 ' CB ' ' A' ' 61' ' ' SER . 47.2 mt -52.29 151.54 3.9 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.814 0.34 . . . . 0.0 111.11 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.584 ' HA ' ' HA ' ' A' ' 44' ' ' CYS . 5.3 t -78.66 167.91 20.53 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.6 179.845 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.64 ' CE1' ' HB2' ' A' ' 45' ' ' ALA . 0.2 OUTLIER -121.49 -176.31 3.27 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-O 120.737 0.303 . . . . 0.0 110.902 179.851 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 4.5 ttm180 -176.28 97.76 0.06 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.254 179.889 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.538 ' HG2' HG12 ' A' ' 57' ' ' VAL . 2.7 mtpt -80.65 148.23 30.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.298 179.487 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -154.17 98.61 2.16 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.835 0.35 . . . . 0.0 111.605 -179.796 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' TRP . . . . . 0.514 ' HB3' HG11 ' A' ' 39' ' ' VAL . 1.8 t90 -77.86 -144.68 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.32 179.409 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 38.5 t -176.71 -36.4 0.01 OUTLIER 'General case' 0 C--O 1.231 0.083 0 CA-C-O 120.744 0.307 . . . . 0.0 111.11 -179.814 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 1.6 t70 77.84 -61.46 0.4 Allowed 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.906 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -174.24 96.17 0.09 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.884 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER 58.88 104.62 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.405 -179.627 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -112.41 -83.56 0.59 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.277 -179.645 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 4.1 p 70.09 -60.22 0.49 Allowed 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.765 0.317 . . . . 0.0 110.639 -179.574 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -110.51 -21.77 11.99 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.964 179.794 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.59 -86.19 0.03 OUTLIER 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 116.627 -0.261 . . . . 0.0 110.945 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.562 ' O ' HG22 ' A' ' 39' ' ' VAL . . . 73.84 -88.48 0.65 Allowed Glycine 0 C--N 1.334 0.455 0 C-N-CA 120.467 -0.873 . . . . 0.0 112.741 179.896 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.462 ' HB3' ' HB2' ' A' ' 70' ' ' LYS . 0.0 OUTLIER 31.54 45.9 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 121.065 0.46 . . . . 0.0 111.872 -179.826 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.562 HG22 ' O ' ' A' ' 37' ' ' GLY . 5.3 m -140.04 90.68 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.829 179.956 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.608 HG21 ' OG1' ' B' ' 191' ' ' THR . 26.9 m -113.07 162.06 11.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.296 -179.704 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 178.38 35.44 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.199 179.858 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.554 HD23 ' H ' ' A' ' 42' ' ' LEU . 0.4 OUTLIER -61.99 128.88 38.27 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.504 179.794 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -135.67 7.49 4.23 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.427 -0.892 . . . . 0.0 113.376 -179.719 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.584 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 0.5 OUTLIER 61.44 131.83 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.169 0.509 . . . . 0.0 111.847 179.345 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.64 ' HB2' ' CE1' ' A' ' 24' ' ' TYR . . . -104.29 -171.83 2.0 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.895 179.861 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -120.54 -16.24 8.35 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 112.117 0.414 . . . . 0.0 112.117 -179.716 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 5.1 t -160.76 26.51 0.15 Allowed 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 111.902 0.334 . . . . 0.0 111.902 -179.784 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER 51.6 53.6 13.48 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-O 120.686 0.279 . . . . 0.0 111.06 179.583 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -70.41 58.88 1.91 Allowed 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.285 1.99 . . . . 0.0 110.338 178.606 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 36.3 t -130.12 133.3 46.55 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.474 -0.784 . . . . 0.0 111.024 -178.364 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 175.22 46.08 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.799 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.405 ' HB2' ' HD2' ' A' ' 53' ' ' PRO . 0.6 OUTLIER -127.96 164.17 38.73 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.707 -179.963 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 53' ' ' PRO . . . . . 0.414 ' O ' ' HG2' ' A' ' 55' ' ' GLU . 11.2 Cg_endo -54.91 -162.97 0.01 OUTLIER 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.725 2.283 . . . . 0.0 112.268 -180.0 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -46.59 96.27 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.378 -179.863 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.414 ' HG2' ' O ' ' A' ' 53' ' ' PRO . 0.2 OUTLIER -113.67 -82.57 0.6 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.908 179.718 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 177.12 -57.43 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.788 0.328 . . . . 0.0 110.97 179.963 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.538 HG12 ' HG2' ' A' ' 26' ' ' LYS . 27.4 m -65.32 154.96 7.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.353 -179.808 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 11.6 t -147.45 22.63 1.16 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.906 179.716 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 10.8 m 60.02 110.92 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.179 179.858 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.498 ' HB3' ' C ' ' A' ' 23' ' ' CYS . 46.9 t -100.29 35.27 2.13 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.422 179.599 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.833 ' CB ' HD13 ' A' ' 22' ' ' LEU . 52.9 p -60.79 80.25 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.117 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.73 -180.0 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.67 HG22 ' HG2' ' A' ' 64' ' ' LYS . 55.0 m 179.47 -33.24 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.364 -0.835 . . . . 0.0 109.384 -179.77 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ASP . . . . . 0.837 ' HB2' HG22 ' A' ' 1' ' ' ILE . 0.8 OUTLIER 70.63 60.91 0.2 Allowed 'General case' 0 C--O 1.23 0.077 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.724 179.548 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.67 ' HG2' HG22 ' A' ' 62' ' ' THR . 5.5 ptmm? 178.82 39.71 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.647 179.267 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 2.3 m -103.01 17.71 23.41 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.04 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 6.6 p-10 -137.55 87.1 17.94 Favored Pre-proline 0 C--N 1.332 -0.186 0 CA-C-O 120.727 0.299 . . . . 0.0 111.481 -179.715 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -79.61 -42.32 0.17 Allowed 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.687 2.258 . . . . 0.0 112.041 179.71 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.419 ' HB3' ' HD2' ' A' ' 69' ' ' PRO . 53.6 m80 -133.28 162.03 60.17 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.534 179.863 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.446 ' HB3' ' C ' ' B' ' 191' ' ' THR . 75.7 Cg_exo -49.39 -63.75 0.27 Allowed 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.414 2.076 . . . . 0.0 112.615 -179.859 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.462 ' HB2' ' HB3' ' A' ' 38' ' ' LYS . 0.0 OUTLIER -88.57 -159.19 0.53 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.834 -179.809 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 39.9 tt0 -96.7 41.69 1.1 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.803 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.03 110.29 2.86 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.859 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -71.12 145.29 48.99 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.467 2.111 . . . . 0.0 112.3 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.131 0 CA-C-O 118.354 -1.248 . . . . 0.0 112.541 -179.988 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 181' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 . . . . . 0 N--CA 1.487 1.397 0 CA-C-O 120.927 0.394 . . . . 0.0 111.16 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 182' ' ' ARG . . . . . . . . . . . . . 1.7 tpp180 66.26 -75.99 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.832 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 183' ' ' GLY . . . . . . . . . . . . . . . 85.76 26.96 33.37 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.425 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 184' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -60.97 177.02 0.36 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.801 0.334 . . . . 0.0 110.85 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 185' ' ' LYS . . . . . 0.418 ' O ' ' CD2' ' B' ' 186' ' ' HIS . 0.0 OUTLIER -174.38 -59.48 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.135 179.959 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 186' ' ' HIS . . . . . 0.418 ' CD2' ' O ' ' B' ' 185' ' ' LYS . 14.1 m80 -142.91 92.37 2.39 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.737 0.304 . . . . 0.0 111.197 -179.839 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 187' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -59.45 -71.39 0.13 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.963 0.411 . . . . 0.0 110.445 179.582 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 188' ' ' VAL . . . . . 0.532 HG23 ' OH ' ' B' ' 190' ' ' TYR . 0.2 OUTLIER -79.68 -165.91 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.496 179.691 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 189' ' ' TYR . . . . . 0.469 ' H ' HG12 ' B' ' 188' ' ' VAL . 35.4 m-85 -104.74 98.78 8.47 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.769 0.319 . . . . 0.0 111.574 -179.431 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 190' ' ' TYR . . . . . 0.532 ' OH ' HG23 ' B' ' 188' ' ' VAL . 0.0 OUTLIER -123.39 105.26 9.67 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.515 179.265 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 191' ' ' THR . . . . . 0.695 HG22 ' OG1' ' A' ' 8' ' ' THR . 0.9 OUTLIER -90.27 17.48 7.09 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.519 -179.982 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 192' ' ' CYS . . . . . 0.719 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.0 OUTLIER -43.22 174.01 0.0 OUTLIER 'General case' 0 CA--C 1.5 -0.962 0 CA-C-O 122.015 0.912 . . . . 0.0 112.198 -179.713 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 193' ' ' CYS . . . . . 0.719 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.0 OUTLIER 47.18 82.45 0.23 Allowed Pre-proline 0 N--CA 1.438 -1.037 0 CA-C-N 113.466 -1.697 . . . . 0.0 111.945 173.799 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 194' ' ' PRO . . . . . 0.408 ' HA ' ' O ' ' A' ' 8' ' ' THR . 50.0 Cg_exo -53.81 172.55 0.25 Allowed 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.677 2.251 . . . . 0.0 112.482 -179.899 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 195' ' ' ASP . . . . . 0.427 ' HB2' ' CD ' ' B' ' 197' ' ' PRO . 8.5 m-20 -71.6 -161.83 0.07 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.815 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 196' ' ' THR . . . . . 0.766 ' C ' ' H ' ' B' ' 198' ' ' TYR . 41.5 p -89.83 -5.17 0.1 Allowed Pre-proline 0 CA--C 1.532 0.256 0 N-CA-C 113.793 1.034 . . . . 0.0 113.793 -179.337 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 197' ' ' PRO . . . . . 0.669 ' CD ' ' N ' ' B' ' 196' ' ' THR . 22.8 Cg_exo -62.29 20.98 0.05 OUTLIER 'Trans proline' 0 C--N 1.357 1.014 0 CA-C-N 120.944 1.373 . . . . 0.0 110.282 177.327 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 198' ' ' TYR . . . . . 0.766 ' H ' ' C ' ' B' ' 196' ' ' THR . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.056 0 CA-C-N 114.713 -1.13 . . . . 0.0 110.931 -179.342 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 1' ' ' ILE . . . . . 0.463 HG23 ' HA ' ' A' ' 62' ' ' THR . 1.7 mp . . . . . 0 N--CA 1.486 1.341 0 CA-C-O 120.953 0.406 . . . . 0.0 111.139 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 0.539 HG21 ' HB ' ' A' ' 15' ' ' THR . 0.3 OUTLIER -160.87 178.15 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.191 -179.914 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.467 ' N ' HG13 ' A' ' 2' ' ' VAL . 4.6 m -67.82 -159.7 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.252 179.79 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' HIS . . . . . 0.457 ' CE1' ' ND2' ' A' ' 66' ' ' ASN . 0.0 OUTLIER -156.84 142.05 17.28 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-O 121.263 0.554 . . . . 0.0 112.122 179.978 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.577 ' HB ' ' HA ' ' A' ' 11' ' ' ILE . 13.4 p -53.98 -31.03 49.48 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.428 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.56 -6.55 1.14 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.61 179.188 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.4 ' O ' ' HB ' ' A' ' 8' ' ' THR . . . -73.0 132.62 43.63 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.199 179.945 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.614 HG23 ' OG1' ' B' ' 191' ' ' THR . 89.4 m 64.03 -77.23 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.077 179.862 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.537 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.0 OUTLIER -101.3 172.65 4.26 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.629 -179.98 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.537 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 10.6 Cg_endo -51.69 -42.77 55.0 Favored 'Trans proline' 0 C--N 1.345 0.392 0 C-N-CA 122.383 2.055 . . . . 0.0 111.456 179.509 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.878 HD12 ' CE2' ' B' ' 198' ' ' TYR . 11.3 mt -149.45 126.03 2.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.636 179.526 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.517 ' H ' ' HB ' ' A' ' 5' ' ' THR . 0.9 OUTLIER -138.6 -17.56 1.12 Allowed 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 112.425 0.528 . . . . 0.0 112.425 -179.462 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.477 ' HA ' HG22 ' A' ' 5' ' ' THR . . . 56.76 58.0 4.38 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.976 0.417 . . . . 0.0 110.819 -179.603 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.78 HG22 ' O ' ' A' ' 14' ' ' VAL . 4.6 p -91.69 29.66 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.243 -179.447 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.539 ' HB ' HG21 ' A' ' 2' ' ' VAL . 30.6 p -73.98 120.94 20.25 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.794 0.331 . . . . 0.0 111.299 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.405 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 1.1 t -58.22 141.43 82.28 Favored Pre-proline 0 CA--C 1.532 0.257 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.472 179.592 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.48 ' HB2' ' HD3' ' A' ' 18' ' ' PRO . 38.6 Cg_exo -58.4 -49.93 10.95 Favored 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 122.298 1.999 . . . . 0.0 112.83 -179.542 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.48 ' HD3' ' HB2' ' A' ' 17' ' ' PRO . 89.3 Cg_endo -81.46 -171.82 1.32 Allowed 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.499 2.133 . . . . 0.0 112.412 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -112.73 144.5 17.97 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.175 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 58.14 72.25 0.53 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.921 0.391 . . . . 0.0 110.65 -179.814 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -119.86 -7.34 10.0 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.647 -179.353 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.978 HD12 ' CB ' ' A' ' 48' ' ' CYS . 1.5 mt 61.88 88.33 0.09 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.53 0.205 . . . . 0.0 110.838 179.773 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.446 ' HA ' ' CA ' ' A' ' 44' ' ' CYS . 1.7 t -59.5 73.94 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.494 -179.794 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.471 ' CB ' ' HA ' ' A' ' 59' ' ' CYS . 0.0 OUTLIER -114.97 156.59 24.78 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.843 -179.069 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.477 ' HB2' ' C ' ' A' ' 42' ' ' LEU . 2.8 ttt180 -144.7 -81.09 0.17 Allowed 'General case' 0 CA--C 1.53 0.208 0 CA-C-O 120.836 0.35 . . . . 0.0 111.559 179.146 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 2.8 mtmm -179.77 110.52 0.04 OUTLIER 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.318 -179.725 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' MET . . . . . 0.543 ' N ' ' HB3' ' A' ' 41' ' ' GLU . 0.5 OUTLIER -89.19 122.54 32.58 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.843 -179.586 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 28' ' ' TRP . . . . . 0.413 ' HB2' ' CB ' ' A' ' 39' ' ' VAL . 0.0 OUTLIER -87.58 -179.86 6.4 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.856 0.36 . . . . 0.0 110.986 179.966 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 8.4 m -158.93 -178.04 6.95 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.798 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -109.24 -75.75 0.62 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.842 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -127.37 -70.07 0.72 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.975 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 37.6 t80 -102.27 -29.34 11.74 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.848 179.821 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 62.23 85.62 0.12 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.786 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 11.4 p -98.97 -57.57 2.14 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.976 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 2.3 p -135.11 31.69 3.22 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.991 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 2.8 mtt85 -107.84 -81.41 0.56 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.872 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 49.83 39.37 32.06 Favored Glycine 0 C--N 1.331 0.271 0 C-N-CA 120.818 -0.706 . . . . 0.0 112.775 179.894 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.572 ' HA ' ' HG2' ' A' ' 70' ' ' LYS . 0.0 OUTLIER -73.33 -179.66 3.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.712 0.291 . . . . 0.0 111.068 -179.814 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.856 HG13 ' O ' ' B' ' 189' ' ' TYR . 29.8 t 80.82 -3.55 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.868 -178.561 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.6 HG11 HG21 ' B' ' 191' ' ' THR . 17.9 m 43.09 -172.8 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.461 0.079 0 N-CA-C 112.674 0.62 . . . . 0.0 112.674 179.231 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.543 ' HB3' ' N ' ' A' ' 27' ' ' MET . 0.3 OUTLIER -169.46 89.91 0.2 Allowed 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.716 -179.07 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.789 HD22 ' ND2' ' A' ' 66' ' ' ASN . 1.6 pp -158.09 127.87 5.97 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-O 121.411 0.624 . . . . 0.0 112.307 179.409 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.432 ' N ' ' O ' ' A' ' 24' ' ' TYR . . . -156.85 -1.34 0.1 OUTLIER Glycine 0 N--CA 1.45 -0.387 0 CA-C-N 115.012 -0.995 . . . . 0.0 112.509 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.483 ' HA ' ' O ' ' A' ' 22' ' ' LEU . 0.7 OUTLIER 59.25 129.86 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.197 0 N-CA-C 113.362 0.875 . . . . 0.0 113.362 178.528 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.416 ' O ' ' N ' ' A' ' 47' ' ' THR . . . -152.92 113.27 4.02 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.091 -0.959 . . . . 0.0 110.237 178.76 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.503 ' C ' HG22 ' A' ' 47' ' ' THR . . . -60.75 78.61 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.97 -179.316 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.676 HG23 ' H ' ' A' ' 48' ' ' CYS . 0.0 OUTLIER 167.71 -77.61 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.688 179.331 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.978 ' CB ' HD12 ' A' ' 22' ' ' LEU . 0.0 OUTLIER 47.41 63.1 10.75 Favored Pre-proline 0 C--O 1.233 0.209 0 CA-C-O 120.991 0.424 . . . . 0.0 111.944 179.353 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.443 ' HD3' ' N ' ' A' ' 48' ' ' CYS . 74.2 Cg_endo -94.84 11.45 1.62 Allowed 'Trans proline' 0 N--CA 1.451 -1.029 0 C-N-CA 123.371 2.714 . . . . 0.0 110.99 178.62 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 46.2 t -61.89 142.11 57.59 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 115.289 -0.869 . . . . 0.0 111.731 -179.241 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 6.9 mttm -164.94 54.1 0.12 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.178 179.718 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.469 ' CB ' ' HD2' ' A' ' 53' ' ' PRO . 0.0 OUTLIER -112.73 168.37 7.79 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.931 -179.525 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 53' ' ' PRO . . . . . 0.469 ' HD2' ' CB ' ' A' ' 52' ' ' LYS . 12.5 Cg_endo -55.81 -162.05 0.01 OUTLIER 'Trans proline' 0 C--N 1.348 0.536 0 C-N-CA 122.778 2.318 . . . . 0.0 112.375 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -55.08 89.63 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.177 -179.871 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -102.73 -73.69 0.65 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.524 179.691 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 172.82 -36.15 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.864 179.868 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 5.5 m -92.05 137.24 22.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.132 0.492 . . . . 0.0 111.911 -179.381 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.411 ' O ' ' HB2' ' A' ' 59' ' ' CYS . 60.1 p -108.85 -19.53 13.37 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.498 179.235 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' CYS . . . . . 0.471 ' HA ' ' CB ' ' A' ' 24' ' ' TYR . 5.4 m 69.19 103.94 0.06 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.864 179.767 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.453 ' O ' ' HB3' ' A' ' 22' ' ' LEU . 0.0 OUTLIER -74.37 -160.39 0.1 Allowed 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.703 179.831 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.706 ' HB2' HD22 ' A' ' 22' ' ' LEU . 0.0 OUTLIER 167.72 137.69 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 120.958 0.409 . . . . 0.0 111.623 179.518 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.463 ' HA ' HG23 ' A' ' 1' ' ' ILE . 0.0 OUTLIER 35.09 -91.66 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 115.474 -0.784 . . . . 0.0 112.158 179.318 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ASP . . . . . 0.41 ' O ' ' N ' ' A' ' 65' ' ' CYS . 9.3 p-10 -55.82 125.64 22.19 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.84 0.353 . . . . 0.0 111.257 -179.689 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 3.3 pttp -56.32 86.98 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.654 179.796 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' CYS . . . . . 0.41 ' N ' ' O ' ' A' ' 63' ' ' ASP . 0.1 OUTLIER -77.24 58.69 1.66 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.297 -179.641 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.789 ' ND2' HD22 ' A' ' 42' ' ' LEU . 1.0 OUTLIER -167.06 55.87 0.34 Allowed Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.756 179.24 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 67' ' ' PRO . . . . . 0.566 ' HD3' ' N ' ' A' ' 66' ' ' ASN . 26.2 Cg_exo -62.03 -65.67 0.06 OUTLIER 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 122.516 2.144 . . . . 0.0 112.41 -179.782 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -110.85 158.32 36.06 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.757 -179.838 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 7.9 Cg_exo -71.09 -74.63 0.01 OUTLIER 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.643 2.229 . . . . 0.0 112.314 -179.691 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.577 ' HD2' ' N ' ' A' ' 70' ' ' LYS . 0.0 OUTLIER 177.41 -102.16 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 116.686 -0.234 . . . . 0.0 111.396 -179.969 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 37.3 tp60 -67.1 89.63 0.18 Allowed 'General case' 0 C--O 1.231 0.086 0 CA-C-O 120.713 0.292 . . . . 0.0 111.216 -179.572 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -162.59 59.04 0.87 Allowed Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.869 179.756 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -63.49 -27.24 70.23 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.511 2.141 . . . . 0.0 112.185 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.143 0 CA-C-O 118.355 -1.247 . . . . 0.0 112.458 179.985 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 181' ' ' TYR . . . . . . . . . . . . . 1.1 p90 . . . . . 0 N--CA 1.486 1.345 0 CA-C-O 120.745 0.307 . . . . 0.0 111.196 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 182' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 71.57 32.99 1.92 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.719 -179.806 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 183' ' ' GLY . . . . . . . . . . . . . . . -107.65 -15.37 15.36 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.769 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 184' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -56.25 155.95 6.25 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.802 0.334 . . . . 0.0 111.052 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 185' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -146.57 -165.83 2.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.962 179.813 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 186' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -140.04 86.61 2.1 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.942 -179.74 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 187' ' ' TRP . . . . . . . . . . . . . 48.3 p90 -74.89 162.48 28.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.055 0.455 . . . . 0.0 111.055 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 188' ' ' VAL . . . . . 0.431 ' CG1' ' CE2' ' B' ' 190' ' ' TYR . 0.1 OUTLIER -97.94 161.09 2.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.914 -179.869 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 189' ' ' TYR . . . . . 0.856 ' O ' HG13 ' A' ' 39' ' ' VAL . 12.4 m-85 -112.18 -8.36 13.99 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.534 179.444 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 190' ' ' TYR . . . . . 0.467 ' N ' ' CD1' ' B' ' 190' ' ' TYR . 0.0 OUTLIER -79.48 143.32 35.03 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 120.853 0.358 . . . . 0.0 110.692 -179.653 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 191' ' ' THR . . . . . 0.614 ' OG1' HG23 ' A' ' 8' ' ' THR . 1.4 t -73.83 -25.35 60.04 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.97 -179.904 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 192' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -45.31 178.31 0.0 OUTLIER 'General case' 0 CA--C 1.504 -0.811 0 CA-C-O 122.03 0.919 . . . . 0.0 112.347 -179.923 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 193' ' ' CYS . . . . . 0.487 ' N ' ' HD3' ' B' ' 194' ' ' PRO . 0.6 OUTLIER 31.24 58.42 1.07 Allowed Pre-proline 0 N--CA 1.438 -1.049 0 CA-C-N 112.782 -2.008 . . . . 0.0 113.209 172.609 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 194' ' ' PRO . . . . . 0.487 ' HD3' ' N ' ' B' ' 193' ' ' CYS . 57.1 Cg_endo -90.53 -68.31 0.01 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.801 0 C-N-CA 122.779 2.319 . . . . 0.0 112.502 179.9 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 178.94 129.77 0.07 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.84 0.352 . . . . 0.0 110.801 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 196' ' ' THR . . . . . 0.676 ' N ' ' HD3' ' B' ' 197' ' ' PRO . 11.4 t -139.4 46.2 1.04 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.95 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 197' ' ' PRO . . . . . 0.676 ' HD3' ' N ' ' B' ' 196' ' ' THR . 5.7 Cg_exo -73.54 12.62 0.84 Allowed 'Trans proline' 0 C--N 1.35 0.639 0 C-N-CA 121.688 1.592 . . . . 0.0 108.699 175.963 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 198' ' ' TYR . . . . . 0.878 ' CE2' HD12 ' A' ' 11' ' ' ILE . 8.2 t80 . . . . . 0 C--O 1.249 1.076 0 CA-C-N 113.963 -1.471 . . . . 0.0 111.273 -178.855 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' ILE . . . . . 0.758 HG23 ' O ' ' A' ' 62' ' ' THR . 29.0 mm . . . . . 0 N--CA 1.486 1.369 0 CA-C-O 120.729 0.299 . . . . 0.0 111.07 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 0.968 HG21 HG22 ' A' ' 15' ' ' THR . 3.6 p -172.37 170.69 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.002 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.565 ' H ' HG22 ' A' ' 2' ' ' VAL . 1.4 p -113.3 -162.14 0.79 Allowed 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 116.649 -0.25 . . . . 0.0 111.112 -179.521 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' HIS . . . . . 0.921 ' HA ' HG22 ' A' ' 14' ' ' VAL . 1.6 p80 -146.3 -175.96 4.98 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.874 0.369 . . . . 0.0 111.089 -179.851 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.886 HG23 ' CB ' ' A' ' 12' ' ' SER . 0.1 OUTLIER -97.9 80.97 2.8 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.69 179.963 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.532 HG21 ' O ' ' A' ' 67' ' ' PRO . 96.7 m -89.77 -3.68 58.04 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.826 179.705 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.518 ' HA ' HG22 ' B' ' 191' ' ' THR . . . -79.4 131.66 36.16 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.738 0.304 . . . . 0.0 110.828 179.838 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 5.1 p 56.67 26.44 11.26 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.696 -179.647 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 81.1 p -169.4 151.15 4.39 Favored Pre-proline 0 C--N 1.33 -0.24 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.886 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.858 ' HG2' HG22 ' B' ' 196' ' ' THR . 34.9 Cg_endo -65.32 -54.01 0.7 Allowed 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.668 2.246 . . . . 0.0 112.633 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 20.0 tt -154.86 152.3 9.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.312 -179.738 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.886 ' CB ' HG23 ' A' ' 5' ' ' THR . 4.3 m -176.53 -158.36 0.05 Allowed 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.163 -179.915 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.4 ' H ' ' HB3' ' A' ' 12' ' ' SER . . . -136.27 135.17 38.77 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-O 120.822 0.344 . . . . 0.0 111.417 -179.868 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.921 HG22 ' HA ' ' A' ' 4' ' ' HIS . 21.1 m -117.24 -53.78 4.27 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.141 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.656 179.695 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.968 HG22 HG21 ' A' ' 2' ' ' VAL . 1.2 p 29.69 79.01 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 122.645 0.378 . . . . 0.0 111.875 -179.781 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.4 m -39.16 96.13 0.11 Allowed Pre-proline 0 CA--C 1.533 0.297 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.874 -179.5 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.579 ' N ' ' HD2' ' A' ' 18' ' ' PRO . 6.8 Cg_endo -53.26 -49.29 17.99 Favored 'Trans proline' 0 C--N 1.348 0.542 0 C-N-CA 122.679 2.253 . . . . 0.0 113.843 -179.393 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.579 ' HD2' ' N ' ' A' ' 17' ' ' PRO . 12.3 Cg_endo -55.83 -80.34 0.02 OUTLIER 'Trans proline' 0 C--N 1.349 0.582 0 C-N-CA 122.186 1.924 . . . . 0.0 112.733 -179.162 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -151.8 -148.31 4.8 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.49 -0.862 . . . . 0.0 112.65 -179.789 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 58.36 -179.39 0.07 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.798 0.332 . . . . 0.0 110.663 -179.869 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.609 ' H ' HD12 ' A' ' 22' ' ' LEU . 14.0 p30 -177.25 39.29 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.898 -179.988 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.738 HD22 ' SG ' ' A' ' 48' ' ' CYS . 0.4 OUTLIER -146.72 81.67 1.56 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.758 179.935 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.837 ' HA ' ' H ' ' A' ' 44' ' ' CYS . 6.5 m -58.02 120.66 8.95 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.994 -179.698 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.897 ' CD1' ' HB2' ' A' ' 45' ' ' ALA . 0.4 OUTLIER -133.47 -32.66 1.14 Allowed 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 113.032 0.753 . . . . 0.0 113.032 -178.303 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.627 ' HB2' ' C ' ' A' ' 42' ' ' LEU . 1.6 ttm180 37.1 -117.55 0.15 Allowed 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 112.677 0.621 . . . . 0.0 112.677 -178.504 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.45 ' C ' ' HB3' ' A' ' 41' ' ' GLU . 0.0 OUTLIER -156.41 126.49 6.48 Favored 'General case' 0 C--N 1.344 0.332 0 C-N-CA 122.351 0.26 . . . . 0.0 110.574 -179.513 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 27' ' ' MET . . . . . 0.477 ' HB2' ' CG ' ' A' ' 41' ' ' GLU . 3.0 tmm? -104.92 159.33 15.89 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.606 0.241 . . . . 0.0 110.881 -179.688 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' TRP . . . . . 0.415 ' O ' ' HA2' ' A' ' 37' ' ' GLY . 3.2 t-105 -130.21 143.71 50.94 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.904 0.383 . . . . 0.0 111.286 179.84 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' CYS . . . . . 0.516 ' HB3' ' N ' ' A' ' 37' ' ' GLY . 0.0 OUTLIER 61.48 131.98 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.853 -179.9 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 3.7 t0 -178.76 -177.94 0.54 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.747 179.887 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . 64.28 -80.8 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.287 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -120.54 56.58 0.98 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.838 0.351 . . . . 0.0 111.033 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 46.4 t -127.04 83.63 2.19 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.909 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 37.2 p -48.59 -43.11 35.73 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-O 120.948 0.404 . . . . 0.0 110.697 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.445 ' O ' ' C ' ' A' ' 36' ' ' ARG . 0.3 OUTLIER -93.27 -151.01 0.29 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.921 179.335 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.475 ' HB3' ' CB ' ' A' ' 29' ' ' CYS . 0.3 OUTLIER 28.6 -139.97 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 122.593 0.357 . . . . 0.0 111.62 179.178 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.516 ' N ' ' HB3' ' A' ' 29' ' ' CYS . . . 65.35 9.23 41.83 Favored Glycine 0 C--N 1.338 0.66 0 C-N-CA 120.041 -1.076 . . . . 0.0 113.17 179.839 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.573 ' HB2' ' CB ' ' B' ' 190' ' ' TYR . 0.0 OUTLIER -99.61 -1.66 37.57 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 117.071 0.436 . . . . 0.0 110.991 179.736 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.709 HG22 ' CD1' ' B' ' 189' ' ' TYR . 4.7 t -78.73 86.62 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 CA-C-O 120.974 0.416 . . . . 0.0 110.147 178.907 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.4 ' CG2' ' CG2' ' B' ' 191' ' ' THR . 30.2 m -50.01 -179.93 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.813 -0.63 . . . . 0.0 112.38 -178.681 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.757 ' O ' ' HG3' ' A' ' 41' ' ' GLU . 5.1 pt-20 -157.71 97.82 1.6 Allowed 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 112.462 0.541 . . . . 0.0 112.462 -178.584 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.875 HD22 ' ND2' ' A' ' 66' ' ' ASN . 0.1 OUTLIER -159.09 112.69 2.33 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.748 0.785 . . . . 0.0 112.833 178.704 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.425 ' N ' ' HB2' ' A' ' 25' ' ' ARG . . . -162.44 26.66 0.24 Allowed Glycine 0 N--CA 1.449 -0.496 0 CA-C-N 114.352 -1.294 . . . . 0.0 111.387 179.413 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.837 ' H ' ' HA ' ' A' ' 23' ' ' CYS . 70.8 m 65.4 140.84 0.02 OUTLIER 'General case' 0 N--CA 1.461 0.115 0 CA-C-O 120.977 0.417 . . . . 0.0 111.685 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.897 ' HB2' ' CD1' ' A' ' 24' ' ' TYR . . . -117.19 -82.47 0.63 Allowed 'General case' 0 C--O 1.232 0.143 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.214 179.779 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.548 ' HB2' ' O ' ' A' ' 45' ' ' ALA . . . 169.22 -39.37 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.897 0.38 . . . . 0.0 110.963 -179.861 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.7 m -162.71 -7.77 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 116.078 -0.51 . . . . 0.0 112.018 -179.417 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.738 ' SG ' HD22 ' A' ' 22' ' ' LEU . 1.5 m 64.22 59.35 1.64 Allowed Pre-proline 0 C--N 1.332 -0.186 0 CA-C-O 120.539 0.209 . . . . 0.0 111.234 179.842 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.51 ' HD3' ' N ' ' A' ' 48' ' ' CYS . 2.9 Cg_endo -79.99 -2.02 11.8 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 122.675 2.25 . . . . 0.0 111.473 178.906 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 34.7 t -53.91 144.78 17.88 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.727 -0.669 . . . . 0.0 111.575 -179.857 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 7.5 pttt 179.99 75.22 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.767 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.42 ' HB2' ' HD2' ' A' ' 53' ' ' PRO . 0.6 OUTLIER -150.49 162.68 26.7 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.837 -179.864 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 53' ' ' PRO . . . . . 0.42 ' HD2' ' HB2' ' A' ' 52' ' ' LYS . 9.8 Cg_endo -50.81 -72.6 0.04 OUTLIER 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.741 2.294 . . . . 0.0 112.257 179.887 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -55.11 -27.11 42.73 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.953 179.904 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 59.21 -87.31 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.952 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.424 ' O ' HG13 ' A' ' 57' ' ' VAL . 13.3 tt0 72.91 6.53 5.36 Favored 'General case' 0 CA--C 1.528 0.115 0 CA-C-O 120.586 0.232 . . . . 0.0 111.207 -179.868 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.448 HG12 ' CD2' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -169.54 145.92 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-O 120.844 0.354 . . . . 0.0 110.839 179.97 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.523 HG22 ' CD ' ' A' ' 41' ' ' GLU . 0.0 OUTLIER -145.74 -99.58 0.1 Allowed 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.562 179.655 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 59' ' ' CYS . . . . . 0.481 ' HA ' ' HB3' ' A' ' 24' ' ' TYR . 0.8 OUTLIER 167.45 172.41 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 120.778 0.323 . . . . 0.0 110.648 179.772 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.536 ' HB2' ' O ' ' A' ' 23' ' ' CYS . 9.7 t -125.05 -86.49 0.63 Allowed 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.117 -179.603 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.453 ' O ' HG23 ' A' ' 62' ' ' THR . 19.6 p 53.59 -158.23 0.16 Allowed 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 120.603 0.24 . . . . 0.0 111.223 179.663 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.758 ' O ' HG23 ' A' ' 1' ' ' ILE . 0.1 OUTLIER 46.83 -90.46 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.565 -179.966 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -127.03 -178.74 4.53 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.817 0.342 . . . . 0.0 111.099 -179.795 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.9 ptpp? -68.22 73.53 0.21 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.854 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 18.0 p -57.28 -31.0 65.16 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.263 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.875 ' ND2' HD22 ' A' ' 42' ' ' LEU . 1.5 m-80 -31.16 92.82 0.05 OUTLIER Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 115.656 -0.702 . . . . 0.0 112.477 -178.642 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' PRO . . . . . 0.532 ' O ' HG21 ' A' ' 6' ' ' THR . 71.7 Cg_endo -90.04 -170.93 0.44 Allowed 'Trans proline' 0 N--CA 1.457 -0.63 0 C-N-CA 123.029 2.486 . . . . 0.0 112.56 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.474 ' HB3' ' HD2' ' A' ' 69' ' ' PRO . 27.3 m80 -110.52 166.01 11.59 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.366 179.707 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.474 ' HD2' ' HB3' ' A' ' 68' ' ' HIS . 83.0 Cg_exo -49.13 133.1 28.99 Favored 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 122.393 2.062 . . . . 0.0 112.013 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.421 ' O ' ' N ' ' A' ' 72' ' ' ARG . 0.1 OUTLIER -46.73 -41.13 14.66 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.473 -179.463 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -65.13 73.61 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.682 179.915 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.421 ' N ' ' O ' ' A' ' 70' ' ' LYS . 0.0 OUTLIER -61.89 147.71 89.19 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.045 -179.852 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -68.89 -25.73 32.51 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 122.586 2.191 . . . . 0.0 112.274 179.884 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.118 0 CA-C-O 118.346 -1.252 . . . . 0.0 112.386 179.98 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 181' ' ' TYR . . . . . . . . . . . . . 4.3 m-85 . . . . . 0 N--CA 1.485 1.315 0 CA-C-O 120.846 0.355 . . . . 0.0 111.213 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 182' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -58.31 -166.68 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.931 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 183' ' ' GLY . . . . . . . . . . . . . . . 166.69 63.63 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.722 -0.752 . . . . 0.0 112.419 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 184' ' ' TRP . . . . . . . . . . . . . 15.2 m95 -136.52 -51.3 0.69 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.738 0.304 . . . . 0.0 110.906 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 185' ' ' LYS . . . . . . . . . . . . . 13.8 tptm 63.54 -78.58 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.829 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 186' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -132.7 70.28 1.47 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.038 0.447 . . . . 0.0 110.699 179.903 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 187' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -60.65 -169.5 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.835 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 188' ' ' VAL . . . . . 0.676 HG13 ' CE1' ' B' ' 190' ' ' TYR . 1.5 t -79.67 125.01 38.55 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.305 0 CA-C-O 121.208 0.528 . . . . 0.0 111.561 -179.574 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 189' ' ' TYR . . . . . 0.709 ' CD1' HG22 ' A' ' 39' ' ' VAL . 0.1 OUTLIER -117.24 -13.78 10.47 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-N 115.373 -0.831 . . . . 0.0 111.549 -179.433 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 190' ' ' TYR . . . . . 0.676 ' CE1' HG13 ' B' ' 188' ' ' VAL . 48.4 p90 -89.41 -178.45 5.6 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.942 0.401 . . . . 0.0 111.927 -179.118 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 191' ' ' THR . . . . . 0.518 HG22 ' HA ' ' A' ' 7' ' ' ALA . 7.3 p -77.53 59.03 1.85 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.246 -179.852 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 192' ' ' CYS . . . . . 0.71 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.0 OUTLIER -48.23 174.89 0.01 OUTLIER 'General case' 0 CA--C 1.499 -0.993 0 CA-C-O 121.927 0.87 . . . . 0.0 111.756 179.829 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 193' ' ' CYS . . . . . 0.71 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.0 OUTLIER 46.51 82.13 0.24 Allowed Pre-proline 0 N--CA 1.44 -0.952 0 CA-C-N 113.598 -1.637 . . . . 0.0 112.043 173.602 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 194' ' ' PRO . . . . . 0.444 ' HA ' ' HB3' ' A' ' 10' ' ' PRO . 93.7 Cg_endo -83.54 52.5 3.86 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.899 2.399 . . . . 0.0 112.644 -179.763 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -178.5 110.72 0.06 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.883 0.373 . . . . 0.0 111.4 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 196' ' ' THR . . . . . 0.858 HG22 ' HG2' ' A' ' 10' ' ' PRO . 4.9 t -152.75 41.9 0.2 Allowed Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.648 179.698 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 197' ' ' PRO . . . . . 0.519 ' CD ' ' N ' ' B' ' 196' ' ' THR . 74.4 Cg_endo -72.77 11.47 0.85 Allowed 'Trans proline' 0 C--N 1.348 0.526 0 C-N-CA 121.607 1.538 . . . . 0.0 108.951 176.277 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 198' ' ' TYR . . . . . 0.58 ' H ' ' C ' ' B' ' 196' ' ' THR . 0.9 OUTLIER . . . . . 0 C--O 1.248 1.019 0 CA-C-N 113.9 -1.5 . . . . 0.0 111.153 -179.088 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 1' ' ' ILE . . . . . 0.408 HD12 ' N ' ' A' ' 1' ' ' ILE . 4.5 mp . . . . . 0 N--CA 1.486 1.363 0 CA-C-O 120.704 0.288 . . . . 0.0 111.055 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 1.036 HG22 HG22 ' A' ' 15' ' ' THR . 53.4 t 62.53 144.47 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.807 -179.925 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 14.5 p -117.48 24.67 10.95 Favored 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 113.34 0.866 . . . . 0.0 113.34 -178.079 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' HIS . . . . . 0.671 ' HA ' HG13 ' A' ' 14' ' ' VAL . 0.0 OUTLIER 68.07 162.7 0.2 Allowed 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 118.185 0.448 . . . . 0.0 110.073 -179.757 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.785 HG21 HG22 ' A' ' 11' ' ' ILE . 1.3 p -78.82 -161.96 0.34 Allowed 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 110.361 -0.237 . . . . 0.0 110.361 -179.95 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 16.9 p -74.98 53.7 0.62 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.769 0.319 . . . . 0.0 111.106 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.444 ' HB3' HG21 ' B' ' 191' ' ' THR . . . 48.24 -148.15 0.22 Allowed 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 116.484 -0.326 . . . . 0.0 110.897 179.894 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.597 HG22 ' HD2' ' A' ' 10' ' ' PRO . 0.2 OUTLIER 75.06 159.0 0.21 Allowed 'General case' 0 N--CA 1.461 0.099 0 CA-C-O 121.14 0.495 . . . . 0.0 111.324 179.585 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.634 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 1.5 p -72.42 -44.9 10.18 Favored Pre-proline 0 CA--C 1.533 0.319 0 CA-C-N 115.744 -0.662 . . . . 0.0 112.16 -179.773 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.634 ' HD2' ' N ' ' A' ' 9' ' ' SER . 47.9 Cg_endo -66.28 -32.48 41.66 Favored 'Trans proline' 0 C--N 1.35 0.626 0 C-N-CA 122.237 1.958 . . . . 0.0 112.652 -179.485 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.785 HG22 HG21 ' A' ' 5' ' ' THR . 2.3 mt 76.48 161.24 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.501 -179.638 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.466 ' N ' HG22 ' A' ' 11' ' ' ILE . 34.3 t -136.91 -120.41 0.15 Allowed 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 121.08 -0.248 . . . . 0.0 111.258 -179.644 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -100.17 123.25 44.19 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-O 120.779 0.323 . . . . 0.0 110.978 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.719 HG12 ' CG1' ' A' ' 2' ' ' VAL . 0.1 OUTLIER -84.47 172.1 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.239 -179.69 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 15' ' ' THR . . . . . 1.036 HG22 HG22 ' A' ' 2' ' ' VAL . 1.6 p 73.29 162.06 0.25 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.312 179.575 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.466 ' HB3' ' CD ' ' A' ' 17' ' ' PRO . 27.2 t -172.01 -60.05 0.0 OUTLIER Pre-proline 0 C--N 1.325 -0.461 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.34 179.867 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.466 ' CD ' ' HB3' ' A' ' 16' ' ' CYS . 19.5 Cg_endo -58.31 106.0 0.24 Allowed 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.382 2.055 . . . . 0.0 112.725 -179.656 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_exo -69.66 -52.81 0.31 Allowed 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.557 2.171 . . . . 0.0 111.399 179.376 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -112.82 -34.5 1.85 Allowed Glycine 0 N--CA 1.45 -0.377 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.999 179.54 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.445 ' HB2' HD12 ' A' ' 22' ' ' LEU . 0.0 OUTLIER -73.12 -175.6 1.88 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.786 0.327 . . . . 0.0 110.792 179.941 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 21.3 m-20 -123.78 -0.4 8.54 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.647 -179.885 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.591 HD22 ' HB2' ' A' ' 59' ' ' CYS . 0.1 OUTLIER -103.81 177.13 4.93 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.773 0.321 . . . . 0.0 110.917 -179.94 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.494 ' HA ' ' HA ' ' A' ' 44' ' ' CYS . 35.6 t -157.88 8.33 0.15 Allowed 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 -179.384 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.631 ' CE1' ' HB3' ' A' ' 45' ' ' ALA . 3.2 m-85 52.18 173.09 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 120.643 0.258 . . . . 0.0 111.001 -179.723 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.477 ' HB2' ' O ' ' A' ' 24' ' ' TYR . 0.6 OUTLIER 161.35 104.28 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.907 179.675 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.418 ' HD2' ' CB ' ' A' ' 41' ' ' GLU . 0.0 OUTLIER -58.0 -179.65 0.05 Allowed 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 178.932 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 27' ' ' MET . . . . . 0.474 ' O ' ' O ' ' A' ' 28' ' ' TRP . 0.0 OUTLIER -146.04 44.75 1.25 Allowed 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.114 -0.635 . . . . 0.0 112.405 -179.522 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 28' ' ' TRP . . . . . 0.63 ' HB2' ' HA2' ' A' ' 37' ' ' GLY . 14.3 p-90 45.65 172.3 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 113.482 0.919 . . . . 0.0 113.482 178.28 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' CYS . . . . . 0.402 ' HB2' ' HE3' ' A' ' 28' ' ' TRP . 0.5 OUTLIER 37.1 -157.72 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 114.855 -1.066 . . . . 0.0 111.996 179.735 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 19.7 t0 -165.95 92.95 0.52 Allowed 'General case' 0 C--N 1.334 -0.096 0 CA-C-O 120.943 0.402 . . . . 0.0 111.206 -179.874 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . 62.79 140.13 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.709 179.578 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 17.6 t80 45.8 84.07 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 115.934 -0.576 . . . . 0.0 111.488 179.751 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 85.4 m -153.19 133.0 13.17 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.092 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -126.06 -44.21 1.77 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.752 179.888 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 1.2 m -93.13 -51.76 4.88 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.815 179.877 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 5.1 mpt_? -57.65 -170.15 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.728 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.63 ' HA2' ' HB2' ' A' ' 28' ' ' TRP . . . 105.07 -133.95 11.81 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.554 -0.831 . . . . 0.0 113.146 179.666 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.51 ' HD3' ' N ' ' A' ' 38' ' ' LYS . 0.0 OUTLIER 62.58 75.29 0.41 Allowed 'General case' 0 C--N 1.334 -0.085 0 CA-C-O 121.054 0.454 . . . . 0.0 110.914 -179.932 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.577 ' N ' ' HB3' ' A' ' 28' ' ' TRP . 17.5 t -157.47 160.61 2.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.511 -179.954 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.508 ' N ' HG12 ' A' ' 39' ' ' VAL . 35.4 m -157.98 175.93 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 116.4 -0.363 . . . . 0.0 110.601 179.912 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.418 ' CB ' ' HD2' ' A' ' 26' ' ' LYS . 0.1 OUTLIER 170.9 -179.08 0.05 OUTLIER 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 120.942 0.401 . . . . 0.0 111.321 179.678 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.634 HD23 ' H ' ' A' ' 42' ' ' LEU . 2.3 pt? -138.43 178.36 7.2 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.696 179.917 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.454 ' CA ' ' HB2' ' A' ' 24' ' ' TYR . . . -161.8 -58.52 0.02 OUTLIER Glycine 0 CA--C 1.518 0.233 0 C-N-CA 120.566 -0.826 . . . . 0.0 112.827 179.918 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.494 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 0.9 OUTLIER 66.88 90.18 0.1 Allowed 'General case' 0 C--O 1.232 0.139 0 CA-C-O 121.034 0.445 . . . . 0.0 110.862 -179.783 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.631 ' HB3' ' CE1' ' A' ' 24' ' ' TYR . . . -128.08 -165.04 1.44 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.897 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -141.51 55.52 1.52 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.953 0.406 . . . . 0.0 110.977 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.52 HG23 ' HD2' ' A' ' 49' ' ' PRO . 4.0 t -175.12 137.66 0.41 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.631 -179.823 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.738 ' N ' ' HD3' ' A' ' 49' ' ' PRO . 56.5 m -118.54 30.43 0.15 Allowed Pre-proline 0 CA--C 1.537 0.479 0 N-CA-C 113.3 0.852 . . . . 0.0 113.3 -179.664 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.738 ' HD3' ' N ' ' A' ' 48' ' ' CYS . 36.3 Cg_exo -59.05 -16.57 33.59 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 121.703 1.602 . . . . 0.0 111.971 179.068 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 6.6 t -38.17 131.71 1.11 Allowed 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.78 -179.614 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 23.0 mtmm -166.59 -38.98 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.092 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.51 ' H ' ' HD2' ' A' ' 53' ' ' PRO . 0.0 OUTLIER -117.81 -67.24 0.02 OUTLIER Pre-proline 0 CA--C 1.533 0.299 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.785 -179.416 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 53' ' ' PRO . . . . . 0.51 ' HD2' ' H ' ' A' ' 52' ' ' LYS . 21.8 Cg_endo -60.45 -85.43 0.01 OUTLIER 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.137 1.891 . . . . 0.0 112.534 -179.43 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' TYR . . . . . 0.452 ' HB3' HG21 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -66.64 80.5 0.1 Allowed 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 120.9 0.381 . . . . 0.0 110.673 -179.962 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -78.99 -78.51 0.15 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.224 -179.636 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -57.08 -21.75 34.18 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.401 -179.571 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.453 ' CG1' ' CD2' ' A' ' 24' ' ' TYR . 61.4 t -54.63 -60.95 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 120.851 0.357 . . . . 0.0 111.003 179.743 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 59.66 111.83 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.693 -179.917 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' CYS . . . . . 0.591 ' HB2' HD22 ' A' ' 22' ' ' LEU . 9.1 p -46.39 -30.17 2.01 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.361 -0.382 . . . . 0.0 111.064 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.501 ' O ' ' CB ' ' A' ' 61' ' ' SER . 0.0 OUTLIER 74.16 172.7 0.28 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.748 179.939 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.501 ' CB ' ' O ' ' A' ' 60' ' ' CYS . 2.8 p 154.06 68.3 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.557 -179.814 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -161.78 173.44 14.61 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.041 -179.899 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -68.85 -42.2 77.43 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.811 179.901 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.437 ' HD2' ' CD2' ' A' ' 4' ' ' HIS . 40.5 mmtm -116.76 84.31 2.12 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.719 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -73.19 -27.09 61.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.178 -179.883 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -128.23 74.09 79.58 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.072 -179.883 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 15.3 Cg_exo -68.57 67.57 1.13 Allowed 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.803 2.335 . . . . 0.0 112.335 -179.817 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 7.5 m80 61.7 153.94 0.11 Allowed Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.032 179.774 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -59.18 -162.22 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.675 2.25 . . . . 0.0 112.19 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.539 ' O ' ' C ' ' A' ' 71' ' ' GLN . 0.0 OUTLIER -121.91 -33.19 3.6 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.491 179.833 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.539 ' C ' ' O ' ' A' ' 70' ' ' LYS . 0.0 OUTLIER -4.03 79.53 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 112.785 0.661 . . . . 0.0 112.785 179.908 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.541 ' HA ' ' NE ' ' A' ' 72' ' ' ARG . 0.0 OUTLIER 142.98 158.48 0.0 OUTLIER Pre-proline 0 N--CA 1.472 0.673 0 C-N-CA 123.896 0.879 . . . . 0.0 110.075 179.83 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -50.32 -52.85 8.13 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 122.557 2.172 . . . . 0.0 112.374 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.125 0 CA-C-O 118.373 -1.237 . . . . 0.0 112.494 -179.997 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 181' ' ' TYR . . . . . . . . . . . . . 36.6 m-85 . . . . . 0 N--CA 1.487 1.378 0 CA-C-O 120.825 0.345 . . . . 0.0 111.109 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 182' ' ' ARG . . . . . . . . . . . . . 30.5 ttt180 -96.03 -40.73 9.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.793 179.921 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 183' ' ' GLY . . . . . . . . . . . . . . . 104.59 26.38 6.51 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.525 179.941 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 184' ' ' TRP . . . . . . . . . . . . . 19.1 t90 68.46 -64.93 0.29 Allowed 'General case' 0 C--O 1.232 0.175 0 CA-C-O 120.749 0.309 . . . . 0.0 111.144 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 185' ' ' LYS . . . . . . . . . . . . . 4.9 tttt 72.19 130.67 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.801 -179.878 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 186' ' ' HIS . . . . . . . . . . . . . 56.3 p-80 -87.14 156.4 19.72 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.07 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 187' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -89.98 -164.62 1.19 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.727 179.902 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 188' ' ' VAL . . . . . 0.467 ' CG1' ' CE1' ' B' ' 190' ' ' TYR . 0.2 OUTLIER -79.91 165.94 2.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.021 -179.912 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 189' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -115.4 48.37 1.19 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.903 0.382 . . . . 0.0 111.175 -179.805 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 190' ' ' TYR . . . . . 0.467 ' CE1' ' CG1' ' B' ' 188' ' ' VAL . 3.4 m-30 -87.66 116.21 25.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.259 179.595 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 191' ' ' THR . . . . . 0.62 HG22 ' O ' ' B' ' 191' ' ' THR . 53.8 m -90.18 60.01 4.65 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.922 0.392 . . . . 0.0 111.318 -179.591 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 192' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -90.38 -65.85 0.98 Allowed 'General case' 0 CA--C 1.502 -0.899 0 CA-C-O 122.23 1.014 . . . . 0.0 111.557 179.549 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 193' ' ' CYS . . . . . 0.583 ' N ' ' CD ' ' B' ' 194' ' ' PRO . 0.5 OUTLIER -144.12 35.29 0.19 Allowed Pre-proline 0 N--CA 1.43 -1.475 0 CA-C-N 113.025 -1.898 . . . . 0.0 112.826 -172.851 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 194' ' ' PRO . . . . . 0.583 ' CD ' ' N ' ' B' ' 193' ' ' CYS . 92.6 Cg_endo -79.89 -34.31 0.96 Allowed 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 122.312 2.008 . . . . 0.0 112.454 179.821 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 195' ' ' ASP . . . . . 0.416 ' C ' ' HD3' ' B' ' 197' ' ' PRO . 36.9 t70 -112.64 39.8 2.41 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.402 -179.531 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 196' ' ' THR . . . . . 0.753 ' N ' ' HD3' ' B' ' 197' ' ' PRO . 15.1 t -112.4 21.78 0.08 OUTLIER Pre-proline 0 CA--C 1.531 0.245 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 179.914 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 197' ' ' PRO . . . . . 0.753 ' HD3' ' N ' ' B' ' 196' ' ' THR . 8.0 Cg_exo -67.36 16.4 0.12 Allowed 'Trans proline' 0 C--N 1.357 1.025 0 CA-C-N 120.427 1.188 . . . . 0.0 109.593 176.304 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 198' ' ' TYR . . . . . 0.681 ' H ' ' C ' ' B' ' 196' ' ' THR . 38.4 t80 . . . . . 0 C--O 1.25 1.106 0 CA-C-N 114.554 -1.203 . . . . 0.0 111.23 -178.939 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' ILE . . . . . 0.443 HG22 ' HG2' ' A' ' 64' ' ' LYS . 6.8 mm . . . . . 0 N--CA 1.487 1.381 0 CA-C-O 120.822 0.344 . . . . 0.0 111.009 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 0.534 ' C ' ' HG3' ' A' ' 64' ' ' LYS . 95.8 t -129.35 138.44 54.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.565 179.602 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.51 ' N ' ' HG3' ' A' ' 64' ' ' LYS . 1.3 m -84.11 -174.56 5.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.507 -178.891 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' HIS . . . . . 0.464 ' N ' ' CD2' ' A' ' 4' ' ' HIS . 0.0 OUTLIER -149.05 127.08 11.95 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.236 179.648 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -45.99 -50.19 15.18 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.151 -179.82 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.573 ' CB ' HD12 ' A' ' 42' ' ' LEU . 21.8 m 47.34 28.1 1.01 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.92 179.471 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.39 -70.1 0.19 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.057 0.456 . . . . 0.0 110.535 179.546 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 1.1 p -135.35 24.93 3.5 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.133 179.238 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.445 ' HB3' ' HB2' ' B' ' 195' ' ' ASP . 0.1 OUTLIER 172.66 169.24 0.24 Allowed Pre-proline 0 C--N 1.332 -0.155 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.116 -179.649 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.451 ' O ' ' N ' ' A' ' 12' ' ' SER . 11.2 Cg_endo -53.47 -79.78 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 122.32 2.013 . . . . 0.0 112.007 179.898 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 32.7 mm 61.22 -75.46 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-O 120.683 0.278 . . . . 0.0 111.502 179.737 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.583 ' O ' ' HB3' ' A' ' 13' ' ' ALA . 0.7 OUTLIER 64.81 -162.18 0.27 Allowed 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.801 -179.903 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.583 ' HB3' ' O ' ' A' ' 12' ' ' SER . . . 80.72 -4.21 1.79 Allowed 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.705 -179.911 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.467 HG23 ' N ' ' A' ' 15' ' ' THR . 15.0 m -48.41 -48.38 13.98 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.094 0 CA-C-O 120.792 0.33 . . . . 0.0 110.788 179.657 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.5 HG22 HG13 ' A' ' 2' ' ' VAL . 9.1 p 44.67 101.78 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.994 179.206 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.437 ' CB ' ' HD2' ' A' ' 17' ' ' PRO . 0.8 OUTLIER -91.05 167.06 16.87 Favored Pre-proline 0 C--N 1.327 -0.407 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.636 179.684 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.437 ' HD2' ' CB ' ' A' ' 16' ' ' CYS . 3.4 Cg_exo -40.73 150.08 0.14 Allowed 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 123.094 2.529 . . . . 0.0 112.83 -179.736 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -59.16 -60.54 0.32 Allowed 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.841 2.36 . . . . 0.0 112.826 -179.596 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -58.84 -141.26 0.01 OUTLIER Glycine 0 CA--C 1.518 0.261 0 CA-C-N 116.004 -0.544 . . . . 0.0 113.116 -179.262 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -57.11 -163.74 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.751 0.31 . . . . 0.0 111.234 -179.672 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 4.8 m120 74.23 69.54 0.1 Allowed 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.764 -179.856 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.43 HD13 ' HZ3' ' A' ' 64' ' ' LYS . 3.4 mm? -86.41 178.85 6.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.961 -179.969 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.539 ' HA ' ' HA ' ' A' ' 44' ' ' CYS . 0.8 OUTLIER -55.01 171.44 0.14 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.098 0.475 . . . . 0.0 111.855 -179.266 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.85 ' CD1' ' HB2' ' A' ' 45' ' ' ALA . 0.0 OUTLIER -109.61 -162.55 0.81 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.731 -179.655 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -165.88 69.2 0.12 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.962 179.695 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.803 ' HD3' HG23 ' A' ' 57' ' ' VAL . 11.6 tptm -95.39 62.44 2.44 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.814 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' MET . . . . . 0.584 ' HG3' HG13 ' A' ' 39' ' ' VAL . 6.4 ttt -97.09 90.59 5.21 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' TRP . . . . . 0.853 ' CB ' HG21 ' A' ' 39' ' ' VAL . 10.7 t-105 -39.78 -86.5 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 -178.948 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' CYS . . . . . 0.459 ' N ' HG11 ' A' ' 39' ' ' VAL . 10.4 t 72.76 154.01 0.14 Allowed 'General case' 0 N--CA 1.462 0.172 0 CA-C-O 120.691 0.282 . . . . 0.0 110.513 -179.554 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -121.29 111.61 17.58 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.869 0.366 . . . . 0.0 111.367 -179.596 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . 57.15 -86.39 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.348 179.683 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 6.3 p90 -108.15 131.31 54.77 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.896 0.379 . . . . 0.0 110.805 -179.845 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -86.44 -166.23 1.49 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.904 -179.969 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 76.42 99.37 0.07 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.354 -179.551 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 4.7 p 60.83 32.12 20.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.539 -179.51 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 9.1 tpt85 -96.1 -84.99 0.34 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.214 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -123.4 -14.63 3.93 Favored Glycine 0 C--N 1.334 0.459 0 C-N-CA 120.388 -0.91 . . . . 0.0 113.56 -179.504 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.475 ' HA ' ' HG3' ' A' ' 70' ' ' LYS . 0.0 OUTLIER 59.46 58.58 2.91 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 117.188 0.494 . . . . 0.0 110.434 -179.621 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.853 HG21 ' CB ' ' A' ' 28' ' ' TRP . 9.1 p -82.09 145.61 8.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.671 -179.324 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 1.061 HG12 HG23 ' B' ' 191' ' ' THR . 3.2 m -81.33 163.96 3.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 N-CA-C 112.304 0.483 . . . . 0.0 112.304 -179.796 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.465 ' HB2' ' N ' ' A' ' 26' ' ' LYS . 1.6 pt-20 -153.43 -154.03 0.5 Allowed 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 115.085 -0.962 . . . . 0.0 109.964 -179.371 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.573 HD12 ' CB ' ' A' ' 6' ' ' THR . 37.9 mt 66.75 136.03 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 121.069 0.462 . . . . 0.0 111.655 179.46 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 176.75 14.13 0.02 OUTLIER Glycine 0 CA--C 1.525 0.672 0 C-N-CA 120.863 -0.684 . . . . 0.0 113.584 179.589 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.539 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 1.3 m 61.06 150.42 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 117.379 0.589 . . . . 0.0 111.222 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.85 ' HB2' ' CD1' ' A' ' 24' ' ' TYR . . . -135.2 -167.74 2.06 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.481 -179.445 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -114.78 -28.33 7.12 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.899 179.527 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.723 HG23 ' HD3' ' A' ' 49' ' ' PRO . 1.8 t -158.09 -120.49 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.464 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.423 ' N ' ' OG1' ' A' ' 47' ' ' THR . 2.1 t -178.01 65.19 0.19 Allowed Pre-proline 0 C--O 1.231 0.119 0 CA-C-O 120.812 0.339 . . . . 0.0 111.103 -179.921 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.723 ' HD3' HG23 ' A' ' 47' ' ' THR . 96.4 Cg_endo -78.78 14.33 1.71 Allowed 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.575 2.184 . . . . 0.0 111.544 178.811 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 31.5 t -61.0 135.71 57.87 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.584 -0.734 . . . . 0.0 111.415 -179.608 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 6.4 pttt 171.15 44.15 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.687 179.72 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.56 165.63 17.16 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.875 -179.87 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_exo -60.03 -68.08 0.05 OUTLIER 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 122.562 2.175 . . . . 0.0 112.339 -179.831 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -69.28 99.61 1.2 Allowed 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.53 179.948 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.498 ' HB3' HG23 ' A' ' 58' ' ' THR . 3.7 mm-40 -109.96 -107.7 0.35 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.241 -179.554 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.751 ' O ' HG23 ' A' ' 57' ' ' VAL . 0.4 OUTLIER 60.63 64.57 1.16 Allowed 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 120.827 0.346 . . . . 0.0 110.513 -179.825 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.803 HG23 ' HD3' ' A' ' 26' ' ' LYS . 0.9 OUTLIER 164.89 -30.54 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.286 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.192 -179.509 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.498 HG23 ' HB3' ' A' ' 55' ' ' GLU . 71.9 p -33.72 157.89 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 115.616 -0.72 . . . . 0.0 112.512 -179.417 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 2.6 p -51.96 -173.79 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.919 -179.509 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.402 ' HB3' ' CB ' ' A' ' 23' ' ' CYS . 0.6 OUTLIER -163.56 70.08 0.22 Allowed 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.616 179.992 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.564 ' O ' ' HB ' ' A' ' 62' ' ' THR . 9.7 p -88.21 128.68 35.46 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.6 -179.492 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.564 ' HB ' ' O ' ' A' ' 61' ' ' SER . 6.0 t 144.41 -146.13 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 108.458 -0.942 . . . . 0.0 108.458 -179.758 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ASP . . . . . 0.425 ' N ' ' OG1' ' A' ' 62' ' ' THR . 19.9 m-20 -74.38 55.39 0.62 Allowed 'General case' 0 C--N 1.332 -0.196 0 N-CA-C 109.684 -0.488 . . . . 0.0 109.684 178.581 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.534 ' HG3' ' C ' ' A' ' 2' ' ' VAL . 1.7 mmtp 36.05 45.46 0.31 Allowed 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 115.387 -0.824 . . . . 0.0 112.479 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' CYS . . . . . 0.471 ' HB2' ' HD3' ' A' ' 67' ' ' PRO . 0.0 OUTLIER 50.19 -82.63 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 115.481 -0.781 . . . . 0.0 112.301 178.651 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.475 ' N ' ' HD3' ' A' ' 67' ' ' PRO . 6.0 t30 52.98 57.61 14.56 Favored Pre-proline 0 CA--C 1.532 0.283 0 CA-C-O 120.752 0.311 . . . . 0.0 111.178 -179.589 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' PRO . . . . . 0.475 ' HD3' ' N ' ' A' ' 66' ' ' ASN . 63.8 Cg_endo -92.38 18.3 1.11 Allowed 'Trans proline' 0 N--CA 1.458 -0.616 0 C-N-CA 122.98 2.453 . . . . 0.0 113.142 -179.552 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.413 ' HB3' ' HD2' ' A' ' 69' ' ' PRO . 79.7 m80 60.83 158.63 0.11 Allowed Pre-proline 0 C--N 1.33 -0.243 0 CA-C-N 116.698 -0.228 . . . . 0.0 110.65 -179.793 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.676 ' HB3' HG22 ' B' ' 191' ' ' THR . 58.8 Cg_endo -71.82 64.12 3.18 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.424 2.082 . . . . 0.0 112.506 -179.706 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.515 ' O ' ' N ' ' A' ' 72' ' ' ARG . 2.4 mmmm 50.67 -87.66 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.174 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.446 ' N ' ' O ' ' A' ' 69' ' ' PRO . 8.2 tp-100 52.21 -80.78 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.173 0 CA-C-N 116.641 -0.254 . . . . 0.0 111.682 179.409 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.515 ' N ' ' O ' ' A' ' 70' ' ' LYS . 1.0 OUTLIER -44.25 110.1 0.95 Allowed Pre-proline 0 CA--C 1.531 0.224 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.246 179.982 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_exo -56.94 -162.09 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.523 2.149 . . . . 0.0 112.311 -179.872 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.111 0 CA-C-O 118.371 -1.238 . . . . 0.0 112.511 -179.951 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 181' ' ' TYR . . . . . . . . . . . . . 7.7 p90 . . . . . 0 N--CA 1.487 1.414 0 CA-C-O 120.82 0.343 . . . . 0.0 111.163 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 182' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.78 80.03 4.25 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.908 -179.977 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 183' ' ' GLY . . . . . . . . . . . . . . . -99.51 32.72 6.86 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.346 179.843 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 184' ' ' TRP . . . . . . . . . . . . . 5.1 m95 -111.1 -160.99 0.73 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.644 0.259 . . . . 0.0 110.794 -179.849 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 185' ' ' LYS . . . . . . . . . . . . . 1.7 tttm 64.64 142.01 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.87 0.367 . . . . 0.0 111.004 179.923 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 186' ' ' HIS . . . . . . . . . . . . . 3.8 m170 -103.25 172.07 7.02 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.866 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 187' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -89.98 -178.42 5.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.82 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 188' ' ' VAL . . . . . 0.411 ' H ' HG23 ' B' ' 188' ' ' VAL . 0.2 OUTLIER -79.96 -44.99 22.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.708 179.938 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 189' ' ' TYR . . . . . 0.735 ' HA ' HG23 ' A' ' 39' ' ' VAL . 0.1 OUTLIER -79.56 129.79 34.79 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.967 179.978 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 190' ' ' TYR . . . . . 0.447 ' H ' HG13 ' A' ' 40' ' ' VAL . 0.2 OUTLIER -156.63 15.91 0.31 Allowed 'General case' 0 CA--C 1.53 0.189 0 N-CA-C 112.924 0.713 . . . . 0.0 112.924 -179.87 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 191' ' ' THR . . . . . 1.061 HG23 HG12 ' A' ' 40' ' ' VAL . 0.0 OUTLIER -90.34 81.57 6.03 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.853 0.359 . . . . 0.0 110.74 179.477 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 192' ' ' CYS . . . . . 0.701 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.5 OUTLIER -90.41 -57.6 2.78 Favored 'General case' 0 CA--C 1.497 -1.059 0 CA-C-O 122.045 0.926 . . . . 0.0 111.473 -179.92 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 193' ' ' CYS . . . . . 0.701 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.0 OUTLIER -155.3 166.7 15.64 Favored Pre-proline 0 N--CA 1.435 -1.203 0 CA-C-N 113.44 -1.709 . . . . 0.0 111.574 -173.647 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 194' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -74.23 -162.41 0.14 Allowed 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.613 2.208 . . . . 0.0 112.365 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 195' ' ' ASP . . . . . 0.445 ' HB2' ' HB3' ' A' ' 9' ' ' SER . 36.9 t70 -133.64 58.52 1.77 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.249 179.622 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 196' ' ' THR . . . . . 0.733 ' N ' ' HD3' ' B' ' 197' ' ' PRO . 16.0 p -101.82 12.13 0.06 OUTLIER Pre-proline 0 CA--C 1.534 0.347 0 N-CA-C 113.893 1.072 . . . . 0.0 113.893 -179.508 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 197' ' ' PRO . . . . . 0.733 ' HD3' ' N ' ' B' ' 196' ' ' THR . 13.5 Cg_exo -66.47 22.78 0.1 OUTLIER 'Trans proline' 0 C--N 1.359 1.116 0 CA-C-N 121.014 1.398 . . . . 0.0 109.934 176.85 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 198' ' ' TYR . . . . . 0.721 ' H ' ' C ' ' B' ' 196' ' ' THR . 35.4 t80 . . . . . 0 C--O 1.248 1.011 0 CA-C-N 114.584 -1.189 . . . . 0.0 111.281 -178.797 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 1' ' ' ILE . . . . . 0.42 ' CG1' ' HA ' ' A' ' 63' ' ' ASP . 1.0 OUTLIER . . . . . 0 N--CA 1.487 1.38 0 CA-C-O 120.396 0.141 . . . . 0.0 110.924 . . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 0.62 ' CG2' HG22 ' A' ' 15' ' ' THR . 84.1 t -42.49 159.7 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.462 0.171 0 CA-C-O 120.528 0.204 . . . . 0.0 111.29 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.507 ' N ' HG12 ' A' ' 2' ' ' VAL . 49.7 t -158.06 41.89 0.28 Allowed 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 112.582 0.586 . . . . 0.0 112.582 -178.716 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' HIS . . . . . 0.752 ' HA ' HG12 ' A' ' 14' ' ' VAL . 0.1 OUTLIER 49.95 -176.91 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.82 0.343 . . . . 0.0 111.687 179.105 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 17.1 p -63.55 -132.05 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.7 179.782 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.417 HG22 ' HB3' ' A' ' 42' ' ' LEU . 6.4 p -96.15 30.84 2.33 Favored 'General case' 0 CA--C 1.528 0.121 0 CA-C-O 120.812 0.339 . . . . 0.0 111.106 -179.857 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 60.93 52.75 4.02 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.911 0.386 . . . . 0.0 111.098 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 25.5 p -96.35 -164.46 1.16 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.721 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.475 ' CB ' ' CD ' ' A' ' 10' ' ' PRO . 0.6 OUTLIER -74.09 -67.35 0.41 Allowed Pre-proline 0 C--N 1.332 -0.181 0 CA-C-N 116.676 -0.238 . . . . 0.0 110.872 -179.981 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.509 ' O ' HG23 ' A' ' 11' ' ' ILE . 49.1 Cg_endo -79.28 -129.59 0.01 OUTLIER 'Trans proline' 0 CA--C 1.535 0.536 0 C-N-CA 122.396 2.064 . . . . 0.0 111.723 179.856 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.509 HG23 ' O ' ' A' ' 10' ' ' PRO . 19.9 pt -159.02 160.66 1.83 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.096 0 CA-C-O 120.625 0.25 . . . . 0.0 110.582 179.846 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 69.8 m -140.5 -84.35 0.22 Allowed 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.963 -0.295 . . . . 0.0 111.358 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -137.37 87.28 2.26 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.803 0.335 . . . . 0.0 110.976 -179.864 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 1.01 HG23 HG23 ' A' ' 15' ' ' THR . 11.9 m -54.12 172.62 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.321 -179.876 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' THR . . . . . 1.01 HG23 HG23 ' A' ' 14' ' ' VAL . 1.1 p 72.11 150.46 0.1 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.129 179.737 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 4.5 m -112.49 116.34 48.49 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.8 179.757 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.453 ' N ' ' CD ' ' A' ' 18' ' ' PRO . 37.1 Cg_exo -58.68 -47.58 18.19 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.216 1.944 . . . . 0.0 112.378 179.787 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.453 ' CD ' ' N ' ' A' ' 17' ' ' PRO . 77.2 Cg_endo -87.16 174.22 5.39 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 122.742 2.295 . . . . 0.0 112.471 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 52.98 -167.06 1.19 Allowed Glycine 0 C--N 1.331 0.276 0 C-N-CA 120.913 -0.66 . . . . 0.0 112.855 179.795 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.62 ' HB2' ' HB2' ' A' ' 46' ' ' ALA . 0.3 OUTLIER -100.21 -153.81 0.46 Allowed 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 110.449 -0.204 . . . . 0.0 110.449 179.813 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.436 ' C ' HD22 ' A' ' 22' ' ' LEU . 28.9 p-10 -106.19 64.8 0.68 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.748 0.308 . . . . 0.0 111.541 -179.574 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.557 HD13 ' CB ' ' A' ' 61' ' ' SER . 4.1 mm? -112.89 7.57 18.35 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.295 179.541 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.708 ' HB3' ' HB3' ' A' ' 60' ' ' CYS . 40.0 t 24.19 43.69 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.477 0.711 . . . . 0.0 112.623 179.867 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.651 ' CE2' HG11 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -36.32 91.52 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.87 178.733 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.465 ' N ' ' O ' ' A' ' 23' ' ' CYS . 2.0 ptt180 -97.18 98.62 10.18 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.883 0.373 . . . . 0.0 111.28 -179.242 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.73 ' HG3' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -68.53 177.4 2.45 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.088 -0.505 . . . . 0.0 109.713 179.195 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 18.1 ttp -176.77 164.47 2.41 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.806 0.336 . . . . 0.0 110.703 179.812 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' TRP . . . . . 0.777 ' CB ' HG21 ' A' ' 39' ' ' VAL . 2.4 t90 -105.74 -137.15 0.36 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.279 179.828 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 71.15 -162.73 0.14 Allowed 'General case' 0 CA--C 1.529 0.165 0 CA-C-O 120.682 0.277 . . . . 0.0 110.558 -179.912 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.538 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 0.1 OUTLIER 173.72 37.36 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.96 179.875 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.538 ' HB3' ' O ' ' A' ' 30' ' ' ASP . . . 76.29 -54.52 0.6 Allowed 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.498 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -46.24 -28.71 1.35 Allowed 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 111.815 0.302 . . . . 0.0 111.815 -179.591 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -83.84 133.81 34.73 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.87 0.367 . . . . 0.0 110.62 179.784 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 74.2 p -64.42 76.93 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.313 -179.638 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 29.6 t 49.15 59.9 4.13 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.287 179.695 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.406 ' C ' ' HD3' ' A' ' 38' ' ' LYS . 4.9 mmm-85 -101.98 -107.53 0.24 Allowed 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.686 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.618 ' O ' HG23 ' A' ' 39' ' ' VAL . . . 76.22 -95.38 1.06 Allowed Glycine 0 C--N 1.335 0.482 0 C-N-CA 120.607 -0.806 . . . . 0.0 113.115 179.745 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.64 ' HG2' ' O ' ' B' ' 189' ' ' TYR . 0.0 OUTLIER 38.72 30.39 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 112.615 0.598 . . . . 0.0 112.615 -179.574 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.805 HG22 ' CA ' ' B' ' 189' ' ' TYR . 4.5 t -96.46 7.26 7.63 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-O 120.844 0.354 . . . . 0.0 110.589 178.212 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.835 HG22 ' OG1' ' B' ' 191' ' ' THR . 4.8 m 25.4 -145.83 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.657 0 C-N-CA 123.707 0.803 . . . . 0.0 113.097 179.202 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.627 ' N ' HG23 ' A' ' 40' ' ' VAL . 0.1 OUTLIER 118.67 106.86 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.082 0.953 . . . . 0.0 110.183 -179.535 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.417 ' HB3' HG22 ' A' ' 6' ' ' THR . 0.5 OUTLIER -50.7 179.84 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.396 -179.673 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.617 ' HA3' ' HB3' ' A' ' 24' ' ' TYR . . . -179.43 -78.37 0.06 OUTLIER Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.292 -0.956 . . . . 0.0 113.259 179.907 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.515 ' H ' ' N ' ' A' ' 24' ' ' TYR . 0.5 OUTLIER 55.44 79.34 0.16 Allowed 'General case' 0 CA--C 1.531 0.221 0 CA-C-O 120.764 0.316 . . . . 0.0 110.684 -179.29 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.436 ' HB3' ' CD1' ' A' ' 24' ' ' TYR . . . -96.52 -160.7 0.81 Allowed 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.492 -179.51 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.62 ' HB2' ' HB2' ' A' ' 20' ' ' GLU . . . -167.28 50.41 0.06 Allowed 'General case' 0 C--N 1.333 -0.115 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.452 -179.705 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.79 HG23 ' HD3' ' A' ' 49' ' ' PRO . 0.0 OUTLIER 178.41 -33.2 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.137 179.871 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.604 ' N ' ' HD3' ' A' ' 49' ' ' PRO . 85.5 m 68.66 34.32 0.1 Allowed Pre-proline 0 CA--C 1.534 0.341 0 N-CA-C 113.519 0.933 . . . . 0.0 113.519 179.135 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.79 ' HD3' HG23 ' A' ' 47' ' ' THR . 44.1 Cg_endo -88.88 13.97 2.37 Favored 'Trans proline' 0 C--N 1.35 0.608 0 C-N-CA 122.08 1.853 . . . . 0.0 110.894 178.106 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.493 ' O ' ' HB2' ' A' ' 51' ' ' LYS . 0.3 OUTLIER -97.05 42.33 1.09 Allowed 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 115.247 -0.888 . . . . 0.0 111.547 -178.726 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.493 ' HB2' ' O ' ' A' ' 50' ' ' SER . 12.5 mttt 74.56 162.53 0.26 Allowed 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.667 -179.638 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.584 ' HB2' ' CD ' ' A' ' 53' ' ' PRO . 0.1 OUTLIER -128.72 -70.51 0.02 OUTLIER Pre-proline 0 CA--C 1.534 0.363 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.891 -179.602 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 53' ' ' PRO . . . . . 0.584 ' CD ' ' HB2' ' A' ' 52' ' ' LYS . 36.8 Cg_endo -66.67 -61.94 0.08 OUTLIER 'Trans proline' 0 C--N 1.352 0.715 0 C-N-CA 121.987 1.791 . . . . 0.0 112.9 -179.641 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' TYR . . . . . 0.448 ' CE1' ' HG2' ' A' ' 53' ' ' PRO . 0.0 OUTLIER -52.38 178.8 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 120.916 0.389 . . . . 0.0 111.649 -179.573 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 41.65 -112.25 0.17 Allowed 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.558 -179.684 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.492 ' O ' ' N ' ' A' ' 58' ' ' THR . 43.1 mm-40 -162.49 -112.62 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 110.225 -0.287 . . . . 0.0 110.225 -179.738 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.73 HG22 ' HG3' ' A' ' 26' ' ' LYS . 21.6 t 58.19 -76.38 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.231 0.094 0 CA-C-O 120.816 0.341 . . . . 0.0 111.574 179.526 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.492 ' N ' ' O ' ' A' ' 56' ' ' GLU . 45.1 p 51.78 26.37 3.47 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.045 -179.722 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' CYS . . . . . 0.636 ' H ' HG12 ' A' ' 57' ' ' VAL . 2.5 m 50.78 -177.3 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.814 -179.759 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.708 ' HB3' ' HB3' ' A' ' 23' ' ' CYS . 2.2 t -141.19 -94.81 0.14 Allowed 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 116.635 -0.257 . . . . 0.0 110.862 -179.858 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.557 ' CB ' HD13 ' A' ' 22' ' ' LEU . 1.6 t 54.25 172.75 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.164 0 CA-C-O 120.892 0.377 . . . . 0.0 111.56 179.394 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.402 ' N ' ' OG ' ' A' ' 61' ' ' SER . 1.2 m 74.64 79.07 0.11 Allowed 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.243 179.679 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ASP . . . . . 0.42 ' HA ' ' CG1' ' A' ' 1' ' ' ILE . 11.5 m-20 52.36 -178.39 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.972 179.881 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.438 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 0.0 OUTLIER -57.35 88.79 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.683 179.851 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 3.2 p -92.13 42.56 1.11 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.466 -179.825 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.417 ' O ' ' CD2' ' A' ' 68' ' ' HIS . 2.3 m-20 -106.67 87.46 2.81 Favored Pre-proline 0 C--N 1.326 -0.433 0 C-N-CA 120.897 -0.321 . . . . 0.0 110.651 179.582 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -73.03 -4.6 15.71 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.727 2.285 . . . . 0.0 113.069 -179.64 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.441 ' HB3' ' HD2' ' A' ' 69' ' ' PRO . 0.3 OUTLIER 64.29 178.56 0.05 OUTLIER Pre-proline 0 C--N 1.331 -0.221 0 N-CA-C 110.396 -0.224 . . . . 0.0 110.396 -179.763 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.441 ' HD2' ' HB3' ' A' ' 68' ' ' HIS . 77.7 Cg_exo -50.24 123.22 10.67 Favored 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.377 2.051 . . . . 0.0 112.479 -179.84 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.28 29.97 2.99 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.919 179.868 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.415 ' HB3' ' CE ' ' A' ' 38' ' ' LYS . 1.5 pp0? -63.51 -39.85 95.52 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.068 -179.857 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 3.3 mmp_? 57.75 98.18 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.995 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -67.3 68.63 0.66 Allowed 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 122.408 2.072 . . . . 0.0 112.29 -179.997 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.41 -1.217 . . . . 0.0 112.386 -179.959 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 181' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.527 0 CA-C-O 120.769 0.319 . . . . 0.0 111.013 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 182' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -158.9 151.09 21.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.957 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 183' ' ' GLY . . . . . . . . . . . . . . . -159.85 149.03 18.36 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.479 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 184' ' ' TRP . . . . . 0.402 ' CD1' ' N ' ' B' ' 184' ' ' TRP . 0.1 OUTLIER -176.66 170.18 2.45 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.937 0.399 . . . . 0.0 111.034 179.987 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 185' ' ' LYS . . . . . 0.446 ' HD2' ' CD2' ' B' ' 186' ' ' HIS . 0.2 OUTLIER -67.23 -80.6 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.736 179.813 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 186' ' ' HIS . . . . . 0.592 ' CE1' HG23 ' B' ' 191' ' ' THR . 25.5 p80 -139.32 -157.77 0.8 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.414 179.857 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 187' ' ' TRP . . . . . . . . . . . . . 4.8 m0 -47.66 172.2 0.01 OUTLIER 'General case' 0 CA--C 1.528 0.123 0 CA-C-O 120.833 0.349 . . . . 0.0 111.068 179.956 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 2.4 t -78.91 -113.99 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.465 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.959 -179.457 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 189' ' ' TYR . . . . . 0.805 ' CA ' HG22 ' A' ' 39' ' ' VAL . 0.4 OUTLIER -79.59 51.09 1.21 Allowed 'General case' 0 N--CA 1.453 -0.312 0 O-C-N 122.223 -0.298 . . . . 0.0 111.274 -179.892 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 190' ' ' TYR . . . . . 0.476 ' HA ' ' O ' ' A' ' 38' ' ' LYS . 9.1 t80 -154.43 87.72 1.19 Allowed 'General case' 0 CA--C 1.516 -0.353 0 CA-C-O 121.425 0.631 . . . . 0.0 110.892 179.84 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 191' ' ' THR . . . . . 0.835 ' OG1' HG22 ' A' ' 40' ' ' VAL . 0.0 OUTLIER -91.25 -50.02 6.05 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 115.015 -0.993 . . . . 0.0 111.495 -179.873 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 192' ' ' CYS . . . . . 0.714 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.0 OUTLIER -43.48 171.52 0.0 OUTLIER 'General case' 0 CA--C 1.498 -1.043 0 CA-C-O 122.284 1.04 . . . . 0.0 112.038 -179.448 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 193' ' ' CYS . . . . . 0.714 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.0 OUTLIER 44.72 49.79 6.35 Favored Pre-proline 0 N--CA 1.435 -1.201 0 CA-C-N 113.073 -1.876 . . . . 0.0 112.412 174.05 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 194' ' ' PRO . . . . . 0.507 ' HD3' ' N ' ' B' ' 193' ' ' CYS . 64.0 Cg_endo -87.24 -25.21 1.09 Allowed 'Trans proline' 0 N--CA 1.459 -0.531 0 C-N-CA 122.596 2.197 . . . . 0.0 112.362 179.671 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -94.69 -173.86 3.13 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.265 -179.611 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 196' ' ' THR . . . . . 0.643 ' N ' ' HD3' ' B' ' 197' ' ' PRO . 0.2 OUTLIER -160.36 48.78 0.26 Allowed Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.634 -179.915 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 197' ' ' PRO . . . . . 0.643 ' HD3' ' N ' ' B' ' 196' ' ' THR . 6.0 Cg_exo -74.93 16.75 0.63 Allowed 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 121.879 1.719 . . . . 0.0 108.768 176.182 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 198' ' ' TYR . . . . . 0.58 ' H ' ' C ' ' B' ' 196' ' ' THR . 11.9 t80 . . . . . 0 C--O 1.25 1.08 0 CA-C-N 113.771 -1.559 . . . . 0.0 111.326 -178.659 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.382 0 CA-C-O 120.816 0.341 . . . . 0.0 111.01 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 0.637 HG11 HG22 ' A' ' 15' ' ' THR . 60.9 t 63.4 159.19 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.826 -179.653 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.513 ' N ' HG12 ' A' ' 2' ' ' VAL . 38.6 m -96.05 177.4 5.75 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.666 -179.657 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' HIS . . . . . 0.806 ' CA ' HG21 ' A' ' 14' ' ' VAL . 0.0 OUTLIER -135.62 160.97 36.85 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.652 -0.249 . . . . 0.0 110.594 179.835 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.633 HG21 ' HA ' ' A' ' 11' ' ' ILE . 20.5 p -21.96 134.43 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 113.373 0.879 . . . . 0.0 113.373 -179.753 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.542 ' OG1' HD11 ' A' ' 42' ' ' LEU . 3.7 t -101.02 -15.13 17.56 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.266 178.852 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.729 ' HB1' ' HG3' ' B' ' 194' ' ' PRO . . . -63.85 -161.73 0.01 OUTLIER 'General case' 0 C--O 1.232 0.142 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.905 179.718 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.753 HG23 ' HD3' ' A' ' 10' ' ' PRO . 2.8 t -57.89 -14.67 6.57 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.81 -0.177 . . . . 0.0 111.3 179.787 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.644 ' CB ' ' O ' ' A' ' 8' ' ' THR . 43.9 t 121.36 14.11 0.0 OUTLIER Pre-proline 0 N--CA 1.476 0.857 0 N-CA-C 114.359 1.244 . . . . 0.0 114.359 178.565 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.78 ' CG ' HG23 ' B' ' 196' ' ' THR . 56.2 Cg_endo -77.42 -88.32 0.0 OUTLIER 'Trans proline' 0 C--N 1.358 1.046 0 CA-C-N 121.209 1.467 . . . . 0.0 112.598 179.758 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.633 ' HA ' HG21 ' A' ' 5' ' ' THR . 8.4 tt -158.39 136.72 2.94 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.16 0 CA-C-O 120.981 0.419 . . . . 0.0 111.402 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.623 ' N ' HG22 ' A' ' 5' ' ' THR . 0.9 OUTLIER -153.95 -168.53 2.99 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.041 -179.933 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -119.21 55.77 0.93 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.019 179.89 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.806 HG21 ' CA ' ' A' ' 4' ' ' HIS . 0.2 OUTLIER -52.61 -100.71 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.343 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.462 -179.78 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.637 HG22 HG11 ' A' ' 2' ' ' VAL . 54.8 p 44.91 91.19 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 120.867 0.365 . . . . 0.0 111.115 -179.999 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.594 ' HB3' ' HD3' ' A' ' 17' ' ' PRO . 14.7 t -120.98 -51.6 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.285 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -179.33 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.594 ' HD3' ' HB3' ' A' ' 16' ' ' CYS . 1.4 Cg_endo -83.47 110.69 1.72 Allowed 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.68 2.253 . . . . 0.0 112.716 -179.196 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -78.0 -63.34 0.03 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.572 0 C-N-CA 122.263 1.976 . . . . 0.0 111.709 179.375 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -134.3 17.01 4.33 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.96 -0.638 . . . . 0.0 112.191 179.32 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.425 ' O ' ' CG ' ' A' ' 21' ' ' ASN . 0.0 OUTLIER 173.17 -165.88 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.702 0.287 . . . . 0.0 110.729 -179.895 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.501 HD21 ' C ' ' A' ' 21' ' ' ASN . 0.0 OUTLIER 67.18 3.93 3.42 Favored 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 112.718 0.636 . . . . 0.0 112.718 179.576 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.679 HD22 ' HB2' ' A' ' 61' ' ' SER . 0.8 OUTLIER 39.04 -161.89 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 178.881 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.461 ' H ' ' H ' ' A' ' 61' ' ' SER . 0.1 OUTLIER -121.28 -11.41 8.8 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.008 -179.935 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.556 ' HB2' ' H ' ' A' ' 44' ' ' CYS . 0.9 OUTLIER 46.54 -174.83 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 120.785 0.326 . . . . 0.0 111.229 -179.738 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.461 ' CD ' ' HG3' ' A' ' 67' ' ' PRO . 14.3 ttt-85 172.56 94.77 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.892 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.411 ' CG ' ' N ' ' A' ' 27' ' ' MET . 0.3 OUTLIER -62.11 163.97 7.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.276 179.483 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 27' ' ' MET . . . . . 0.411 ' N ' ' CG ' ' A' ' 26' ' ' LYS . 66.0 ttp -153.71 163.27 40.29 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.607 179.685 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' TRP . . . . . 0.824 ' HB2' HG11 ' A' ' 39' ' ' VAL . 0.0 OUTLIER -114.98 -74.15 0.62 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.06 179.963 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 1.5 m 60.32 52.0 5.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.913 0.387 . . . . 0.0 110.715 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.417 ' HB3' ' CE3' ' A' ' 28' ' ' TRP . 3.6 p30 -87.41 157.5 19.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.097 -179.85 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . 57.16 52.44 8.99 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.162 179.712 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER 56.26 97.43 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.795 179.962 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.42 ' O ' ' N ' ' A' ' 35' ' ' SER . 0.3 OUTLIER -56.56 -73.72 0.06 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.058 -179.827 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 16.3 t 55.08 -85.89 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.014 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.42 ' N ' ' O ' ' A' ' 33' ' ' CYS . 56.7 p -101.09 23.82 10.26 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.867 0.365 . . . . 0.0 110.769 179.663 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.411 ' CA ' ' HE3' ' A' ' 70' ' ' LYS . 0.2 OUTLIER -119.7 -163.07 0.96 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.499 179.987 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 122.01 11.38 5.83 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.545 -0.836 . . . . 0.0 112.85 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.86 56.18 2.65 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.037 0.446 . . . . 0.0 110.762 179.797 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.824 HG11 ' HB2' ' A' ' 28' ' ' TRP . 23.8 t -122.24 141.3 43.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.725 179.927 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.625 HG21 ' HB ' ' B' ' 191' ' ' THR . 35.7 m -141.83 -178.5 1.36 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 120.927 0.394 . . . . 0.0 111.461 -179.871 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 171.93 -28.81 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.057 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.542 HD11 ' OG1' ' A' ' 6' ' ' THR . 41.8 mt 69.73 158.2 0.17 Allowed 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.808 -179.763 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.457 ' HA3' ' CB ' ' A' ' 24' ' ' TYR . . . -139.64 -65.97 0.04 OUTLIER Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.364 -0.922 . . . . 0.0 113.184 -179.739 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.556 ' H ' ' HB2' ' A' ' 24' ' ' TYR . 24.3 t 51.86 86.94 0.03 OUTLIER 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 117.081 0.44 . . . . 0.0 110.166 -179.539 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.424 ' O ' ' HA ' ' A' ' 21' ' ' ASN . . . -153.56 155.91 37.04 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.966 0.412 . . . . 0.0 111.989 -178.97 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.488 ' HA ' ' HA ' ' A' ' 21' ' ' ASN . . . -85.66 80.13 9.11 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.436 179.941 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.45 ' OG1' ' N ' ' A' ' 48' ' ' CYS . 0.6 OUTLIER -170.58 -179.61 2.99 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.649 179.831 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.676 ' O ' ' N ' ' A' ' 50' ' ' SER . 0.5 OUTLIER 179.02 -48.24 0.0 OUTLIER Pre-proline 0 C--N 1.333 -0.148 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.568 179.934 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.426 ' CD ' ' N ' ' A' ' 48' ' ' CYS . 53.8 Cg_exo -52.28 72.56 0.02 OUTLIER 'Trans proline' 0 C--N 1.351 0.694 0 C-N-CA 122.083 1.855 . . . . 0.0 111.067 179.685 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.676 ' N ' ' O ' ' A' ' 48' ' ' CYS . 28.7 t -118.63 -80.01 0.61 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.378 -0.828 . . . . 0.0 111.258 -178.342 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 10.2 mtmm 58.91 34.21 23.51 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.836 0.351 . . . . 0.0 111.043 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.41 162.44 33.69 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.809 179.925 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -60.32 -67.84 0.05 OUTLIER 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.494 2.129 . . . . 0.0 112.117 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -74.34 -13.25 60.72 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.134 179.937 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 63.17 -80.14 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.941 -179.913 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.476 ' O ' HG23 ' A' ' 57' ' ' VAL . 17.1 tt0 58.81 23.97 11.84 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.986 179.924 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.494 HG12 ' CD1' ' A' ' 24' ' ' TYR . 71.0 t -159.4 -76.6 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.625 -179.881 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 60.15 118.39 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.35 179.785 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' CYS . . . . . 0.489 ' HA ' ' CD1' ' A' ' 24' ' ' TYR . 1.2 m -50.97 138.76 18.67 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.939 179.67 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.611 ' SG ' ' N ' ' A' ' 65' ' ' CYS . 48.5 t -112.07 -83.91 0.58 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.708 -179.593 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.679 ' HB2' HD22 ' A' ' 22' ' ' LEU . 47.0 t 65.65 -148.32 0.22 Allowed 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.138 -179.32 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.528 HG23 ' O ' ' A' ' 61' ' ' SER . 0.2 OUTLIER 49.09 -86.82 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 122.147 0.179 . . . . 0.0 111.22 -179.806 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ASP . . . . . 0.491 ' O ' ' NE2' ' A' ' 4' ' ' HIS . 1.6 p30 -153.64 79.03 1.15 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.666 0.269 . . . . 0.0 111.659 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.5 ' HB2' ' HB3' ' A' ' 3' ' ' CYS . 0.0 OUTLIER 41.19 23.61 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.788 0.662 . . . . 0.0 112.788 179.365 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 65' ' ' CYS . . . . . 0.611 ' N ' ' SG ' ' A' ' 60' ' ' CYS . 0.5 OUTLIER 69.82 -42.39 0.51 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.722 0.296 . . . . 0.0 111.016 179.998 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.617 ' N ' ' HD3' ' A' ' 67' ' ' PRO . 6.0 t30 57.37 53.33 6.29 Favored Pre-proline 0 C--O 1.232 0.179 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.677 -179.659 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' PRO . . . . . 0.617 ' HD3' ' N ' ' A' ' 66' ' ' ASN . 19.5 Cg_endo -92.29 -66.36 0.01 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.945 0 C-N-CA 123.075 2.517 . . . . 0.0 111.521 179.148 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.592 ' HB3' ' HD2' ' A' ' 69' ' ' PRO . 33.5 m80 58.21 166.24 0.07 OUTLIER Pre-proline 0 C--N 1.331 -0.197 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.087 179.148 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.592 ' HD2' ' HB3' ' A' ' 68' ' ' HIS . 28.2 Cg_exo -35.15 123.72 0.21 Allowed 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 123.1 2.533 . . . . 0.0 113.145 -179.798 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.413 ' HD3' ' N ' ' A' ' 71' ' ' GLN . 0.0 OUTLIER -98.08 -7.18 30.2 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.236 -179.964 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.413 ' N ' ' HD3' ' A' ' 70' ' ' LYS . 2.1 tt0 -76.49 -16.84 59.56 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.424 179.937 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.514 ' HB2' ' HD3' ' A' ' 73' ' ' PRO . 3.9 mmp_? -66.09 -56.06 18.5 Favored Pre-proline 0 CA--C 1.531 0.238 0 CA-C-N 116.618 -0.265 . . . . 0.0 111.618 -179.592 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.514 ' HD3' ' HB2' ' A' ' 72' ' ' ARG . 36.1 Cg_endo -64.53 -46.26 7.56 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 122.182 1.922 . . . . 0.0 112.264 -179.96 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.444 -1.198 . . . . 0.0 112.499 179.995 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 181' ' ' TYR . . . . . . . . . . . . . 5.0 t80 . . . . . 0 N--CA 1.487 1.377 0 CA-C-O 120.771 0.319 . . . . 0.0 111.102 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 182' ' ' ARG . . . . . . . . . . . . . 28.3 ttp85 -149.56 99.74 2.92 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.9 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 183' ' ' GLY . . . . . . . . . . . . . . . -157.03 47.45 0.47 Allowed Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.458 -179.958 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 184' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -128.24 135.58 49.87 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.847 0.356 . . . . 0.0 110.878 179.925 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 185' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -87.62 -168.26 2.16 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.843 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 186' ' ' HIS . . . . . . . . . . . . . 50.5 t-80 -88.2 -80.79 0.27 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.773 179.876 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 187' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -88.86 166.96 13.63 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 120.827 0.346 . . . . 0.0 110.86 179.807 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 188' ' ' VAL . . . . . 0.401 HG23 ' H ' ' B' ' 188' ' ' VAL . 0.2 OUTLIER -79.88 -71.99 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.434 -179.594 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 189' ' ' TYR . . . . . . . . . . . . . 9.7 m-85 -107.94 153.77 22.57 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.519 -0.31 . . . . 0.0 111.151 -179.638 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 190' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -160.15 104.8 1.5 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 121.169 0.509 . . . . 0.0 111.422 179.738 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 191' ' ' THR . . . . . 0.625 ' HB ' HG21 ' A' ' 40' ' ' VAL . 1.3 t -91.08 43.5 1.15 Allowed 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.925 179.314 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 192' ' ' CYS . . . . . 0.706 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.5 OUTLIER -90.21 -56.86 3.05 Favored 'General case' 0 CA--C 1.497 -1.077 0 CA-C-O 121.798 0.809 . . . . 0.0 112.007 -179.401 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 193' ' ' CYS . . . . . 0.706 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.0 OUTLIER -153.98 103.17 2.46 Favored Pre-proline 0 N--CA 1.436 -1.15 0 CA-C-N 113.734 -1.576 . . . . 0.0 111.964 -173.444 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 194' ' ' PRO . . . . . 0.729 ' HG3' ' HB1' ' A' ' 7' ' ' ALA . 38.3 Cg_endo -81.74 -66.7 0.02 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.768 0 C-N-CA 122.395 2.063 . . . . 0.0 111.979 179.486 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -172.63 14.88 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 113.294 0.85 . . . . 0.0 113.294 179.819 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 196' ' ' THR . . . . . 0.78 HG23 ' CG ' ' A' ' 10' ' ' PRO . 1.4 t -147.2 36.85 0.17 Allowed Pre-proline 0 C--N 1.334 -0.094 0 C-N-CA 120.389 -0.524 . . . . 0.0 112.024 179.725 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 197' ' ' PRO . . . . . 0.595 ' HB3' HG21 ' A' ' 8' ' ' THR . 72.1 Cg_endo -72.2 13.7 0.51 Allowed 'Trans proline' 0 C--N 1.35 0.612 0 C-N-CA 121.518 1.478 . . . . 0.0 109.359 176.113 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 198' ' ' TYR . . . . . 0.591 ' H ' ' C ' ' B' ' 196' ' ' THR . 1.1 t80 . . . . . 0 C--O 1.248 0.976 0 CA-C-N 114.12 -1.4 . . . . 0.0 111.289 -178.926 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' ILE . . . . . 0.733 HD13 HG12 ' A' ' 2' ' ' VAL . 0.1 OUTLIER . . . . . 0 N--CA 1.485 1.309 0 CA-C-O 120.466 0.174 . . . . 0.0 110.812 . . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 0.733 HG12 HD13 ' A' ' 1' ' ' ILE . 4.0 p 147.44 138.08 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 C-N-CA 123.461 0.705 . . . . 0.0 110.439 179.388 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.487 ' O ' ' C ' ' A' ' 4' ' ' HIS . 0.5 OUTLIER -160.08 54.01 0.34 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.68 -179.719 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 4' ' ' HIS . . . . . 0.545 ' N ' HG23 ' A' ' 14' ' ' VAL . 4.9 p-80 -23.7 110.31 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 122.659 0.384 . . . . 0.0 112.033 179.627 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.411 ' CG2' ' N ' ' A' ' 13' ' ' ALA . 2.6 t -44.82 149.86 0.4 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.07 -0.513 . . . . 0.0 111.319 -179.642 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.757 HG22 ' HB3' ' A' ' 66' ' ' ASN . 16.8 p -81.01 2.34 27.41 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.448 -179.935 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.507 ' C ' HG23 ' A' ' 8' ' ' THR . . . -58.19 88.69 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.727 0.299 . . . . 0.0 111.205 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.816 HG22 ' O ' ' B' ' 192' ' ' CYS . 1.2 p 71.1 173.7 0.31 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.049 0.452 . . . . 0.0 111.206 179.55 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.503 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 6.0 t -58.8 -58.91 15.79 Favored Pre-proline 0 C--N 1.33 -0.283 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.752 -179.695 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.8 ' O ' HG23 ' A' ' 11' ' ' ILE . 9.5 Cg_endo -52.01 -93.27 0.0 OUTLIER 'Trans proline' 0 CA--C 1.534 0.495 0 C-N-CA 122.505 2.137 . . . . 0.0 112.652 -179.168 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.8 HG23 ' O ' ' A' ' 10' ' ' PRO . 0.2 OUTLIER 170.9 176.66 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.277 0 CA-C-O 120.664 0.269 . . . . 0.0 110.742 -179.797 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.578 ' O ' ' HB2' ' A' ' 13' ' ' ALA . 0.4 OUTLIER -177.09 17.24 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 179.669 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.578 ' HB2' ' O ' ' A' ' 12' ' ' SER . . . 168.54 66.03 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.756 0.312 . . . . 0.0 111.741 179.814 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.607 ' C ' HG23 ' A' ' 15' ' ' THR . 6.9 p -89.95 165.11 2.05 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.584 179.627 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.692 ' HA ' ' HA ' ' A' ' 2' ' ' VAL . 2.1 p 85.57 106.68 0.05 OUTLIER 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 122.962 0.505 . . . . 0.0 110.961 -179.684 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.471 ' N ' ' HD3' ' A' ' 17' ' ' PRO . 46.5 t -133.83 59.45 39.17 Favored Pre-proline 0 CA--C 1.533 0.294 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.721 -179.905 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.535 ' CB ' ' HD3' ' A' ' 18' ' ' PRO . 10.5 Cg_exo -66.79 -55.49 0.33 Allowed 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 122.058 1.839 . . . . 0.0 112.98 179.996 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.535 ' HD3' ' CB ' ' A' ' 17' ' ' PRO . 43.4 Cg_endo -97.16 -166.5 0.1 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.77 0 C-N-CA 122.818 2.345 . . . . 0.0 112.795 -179.4 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 78.33 -65.4 3.37 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.801 179.48 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -113.32 156.42 23.4 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.978 0.418 . . . . 0.0 111.207 -179.577 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.724 ' O ' HD13 ' A' ' 22' ' ' LEU . 0.2 OUTLIER -103.3 40.21 1.44 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.62 179.871 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.724 HD13 ' O ' ' A' ' 21' ' ' ASN . 0.6 OUTLIER 165.82 -172.99 0.02 OUTLIER 'General case' 0 N--CA 1.461 0.121 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.033 -179.692 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.575 ' HB2' ' C ' ' A' ' 60' ' ' CYS . 1.6 m -120.32 88.55 2.96 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.429 0.633 . . . . 0.0 111.292 -179.835 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.655 ' HD2' HD22 ' A' ' 42' ' ' LEU . 14.7 t80 -78.51 125.38 29.29 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.063 -0.971 . . . . 0.0 112.201 -179.254 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.659 ' NH1' HG22 ' A' ' 58' ' ' THR . 0.0 OUTLIER -155.97 137.72 14.29 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.651 -0.25 . . . . 0.0 110.653 179.263 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.644 ' HG2' HG12 ' A' ' 57' ' ' VAL . 4.5 mttt -80.04 145.25 32.58 Favored 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 120.901 -0.32 . . . . 0.0 110.922 -179.831 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' MET . . . . . 0.457 ' HE1' ' HG2' ' A' ' 67' ' ' PRO . 50.1 tpp -153.49 146.05 24.14 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.332 -179.783 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' TRP . . . . . 0.564 ' HB3' HG21 ' A' ' 39' ' ' VAL . 0.3 OUTLIER -149.04 -160.54 1.19 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.768 179.88 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 29' ' ' CYS . . . . . 0.641 ' HA ' ' HB3' ' A' ' 33' ' ' CYS . 0.1 OUTLIER 85.68 -17.6 0.4 Allowed 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 122.806 0.442 . . . . 0.0 111.724 -179.921 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.41 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 41.1 m-20 -54.19 126.73 24.05 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.776 0.322 . . . . 0.0 110.978 -179.91 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.41 ' HB3' ' O ' ' A' ' 30' ' ' ASP . . . 67.28 -72.29 0.09 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.878 -179.793 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.452 ' O ' ' SG ' ' A' ' 33' ' ' CYS . 18.6 m-85 -71.63 -164.24 0.12 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.34 179.647 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.641 ' HB3' ' HA ' ' A' ' 29' ' ' CYS . 0.5 OUTLIER 74.51 -50.12 0.67 Allowed 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 112.094 0.405 . . . . 0.0 112.094 179.554 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.402 ' N ' ' SG ' ' A' ' 33' ' ' CYS . 0.3 OUTLIER 53.73 55.6 8.28 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.871 0.367 . . . . 0.0 110.685 -179.854 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 67.28 35.2 4.5 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.14 -179.811 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -144.71 12.8 1.49 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.866 -179.909 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.432 ' N ' ' HB2' ' A' ' 33' ' ' CYS . . . -87.7 -52.39 3.0 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.647 -0.787 . . . . 0.0 112.862 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.522 ' HG3' ' HB3' ' B' ' 190' ' ' TYR . 0.0 OUTLIER 36.47 74.91 0.07 Allowed 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 120.839 0.352 . . . . 0.0 111.111 -179.677 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.564 HG21 ' HB3' ' A' ' 28' ' ' TRP . 18.9 t -118.64 124.81 73.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 121.174 0.511 . . . . 0.0 111.917 -179.082 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 27.1 m -158.3 159.37 2.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.838 179.31 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.423 ' CG ' ' HB2' ' A' ' 26' ' ' LYS . 0.1 OUTLIER 175.52 -87.15 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.936 0.717 . . . . 0.0 112.936 -179.656 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.655 HD22 ' HD2' ' A' ' 24' ' ' TYR . 0.3 OUTLIER -51.77 -175.75 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.14 0 N-CA-C 112.88 0.696 . . . . 0.0 112.88 -177.761 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 166.59 93.84 0.09 OUTLIER Glycine 0 N--CA 1.448 -0.554 0 N-CA-C 110.165 -1.174 . . . . 0.0 110.165 -179.209 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.507 ' N ' ' O ' ' A' ' 24' ' ' TYR . 0.1 OUTLIER 76.57 109.29 0.08 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.041 0.448 . . . . 0.0 110.49 -178.155 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.551 ' O ' ' N ' ' A' ' 47' ' ' THR . . . -173.5 147.11 1.42 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.137 -179.668 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.512 ' C ' HG22 ' A' ' 47' ' ' THR . . . 47.33 -82.43 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.709 179.394 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.551 ' N ' ' O ' ' A' ' 45' ' ' ALA . 1.2 t 156.76 62.19 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.402 179.821 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.537 ' CB ' HD23 ' A' ' 22' ' ' LEU . 49.6 t 43.91 53.51 10.41 Favored Pre-proline 0 N--CA 1.466 0.375 0 N-CA-C 111.787 0.292 . . . . 0.0 111.787 179.688 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.515 ' HD3' ' N ' ' A' ' 48' ' ' CYS . 37.4 Cg_exo -55.0 -25.45 44.6 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 121.984 1.789 . . . . 0.0 111.002 179.088 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.402 ' HB2' ' CG2' ' A' ' 57' ' ' VAL . 3.0 t -55.78 179.95 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.206 -0.906 . . . . 0.0 111.323 179.751 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 11.8 ptpt 175.89 -47.72 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.035 179.881 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.436 ' HB2' ' CE2' ' A' ' 54' ' ' TYR . 0.0 OUTLIER -75.02 149.27 85.08 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.974 -179.898 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -59.32 -47.66 16.34 Favored 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.59 2.194 . . . . 0.0 112.364 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' TYR . . . . . 0.436 ' CE2' ' HB2' ' A' ' 52' ' ' LYS . 0.0 OUTLIER -64.49 75.91 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.996 -179.751 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -152.27 -160.36 1.13 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.161 -179.877 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.482 ' O ' ' HA ' ' A' ' 26' ' ' LYS . 17.9 tt0 -148.87 21.28 1.0 Allowed 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 120.525 0.202 . . . . 0.0 110.604 179.452 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.644 HG12 ' HG2' ' A' ' 26' ' ' LYS . 4.8 m -145.61 -174.12 0.47 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.106 0 CA-C-O 120.891 0.376 . . . . 0.0 110.989 179.63 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.659 HG22 ' NH1' ' A' ' 25' ' ' ARG . 8.9 t 178.39 -170.28 0.1 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.425 179.569 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -101.29 134.78 43.82 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.872 0.367 . . . . 0.0 110.292 179.681 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.575 ' C ' ' HB2' ' A' ' 23' ' ' CYS . 0.5 OUTLIER -123.45 15.68 9.65 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.448 -179.418 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.584 ' O ' HG23 ' A' ' 62' ' ' THR . 0.3 OUTLIER -64.94 95.16 0.15 Allowed 'General case' 0 C--N 1.333 -0.116 0 CA-C-O 121.057 0.456 . . . . 0.0 111.289 -179.123 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.584 HG23 ' O ' ' A' ' 61' ' ' SER . 0.1 OUTLIER 168.39 67.81 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.377 179.826 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ASP . . . . . 0.621 ' HA ' HG13 ' A' ' 2' ' ' VAL . 1.2 t0 64.81 -163.91 0.25 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.551 -179.737 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.416 ' HB3' ' CE1' ' A' ' 4' ' ' HIS . 0.0 OUTLIER -60.74 87.59 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.88 0.371 . . . . 0.0 110.306 179.864 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 16.7 t -94.95 -50.01 5.3 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.941 -179.735 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.757 ' HB3' HG22 ' A' ' 6' ' ' THR . 29.4 m-20 -43.29 100.47 0.23 Allowed Pre-proline 0 N--CA 1.463 0.201 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.533 -179.761 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' PRO . . . . . 0.457 ' HG2' ' HE1' ' A' ' 27' ' ' MET . 95.6 Cg_endo -90.89 131.57 1.53 Allowed 'Trans proline' 0 N--CA 1.454 -0.797 0 C-N-CA 122.732 2.288 . . . . 0.0 112.059 -180.0 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 5.7 p80 -48.0 161.49 0.36 Allowed Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.726 179.83 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.552 ' HG2' ' HB ' ' B' ' 191' ' ' THR . 75.3 Cg_exo -47.21 173.07 0.03 OUTLIER 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.429 2.086 . . . . 0.0 112.083 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.436 ' O ' ' C ' ' A' ' 71' ' ' GLN . 0.0 OUTLIER -54.47 -27.35 36.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.034 -179.817 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.436 ' C ' ' O ' ' A' ' 70' ' ' LYS . 22.8 tp60 25.42 -91.15 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.487 0 O-C-N 123.571 0.544 . . . . 0.0 112.388 179.78 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.489 ' HB2' ' HD3' ' A' ' 73' ' ' PRO . 0.0 OUTLIER -96.2 -53.13 0.22 Allowed Pre-proline 0 CA--C 1.528 0.128 0 CA-C-O 120.47 0.176 . . . . 0.0 110.762 179.767 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.489 ' HD3' ' HB2' ' A' ' 72' ' ' ARG . 15.5 Cg_exo -68.67 113.32 3.14 Favored 'Trans proline' 0 C--N 1.349 0.559 0 C-N-CA 122.42 2.08 . . . . 0.0 112.162 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.088 0 CA-C-O 118.313 -1.27 . . . . 0.0 112.521 -179.937 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 181' ' ' TYR . . . . . . . . . . . . . 9.5 p90 . . . . . 0 N--CA 1.486 1.351 0 CA-C-O 120.562 0.22 . . . . 0.0 111.059 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 182' ' ' ARG . . . . . . . . . . . . . 1.6 mtp85 68.61 30.95 4.89 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.891 0.376 . . . . 0.0 110.656 -179.835 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 183' ' ' GLY . . . . . . . . . . . . . . . -150.84 53.53 0.49 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.896 -0.668 . . . . 0.0 112.3 179.883 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 184' ' ' TRP . . . . . . . . . . . . . 16.4 m95 -91.7 12.68 20.42 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.75 0.31 . . . . 0.0 111.465 -179.809 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 185' ' ' LYS . . . . . . . . . . . . . 38.4 tttt -49.68 128.65 18.31 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.931 0.396 . . . . 0.0 111.215 -179.825 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 186' ' ' HIS . . . . . . . . . . . . . 9.5 t-160 -119.7 78.92 1.37 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.77 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 187' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -84.76 -172.5 4.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.044 -179.884 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 188' ' ' VAL . . . . . 0.432 HG21 ' HE2' ' A' ' 38' ' ' LYS . 0.1 OUTLIER -90.83 -169.93 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.24 -179.654 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 189' ' ' TYR . . . . . 0.405 ' CE1' ' OE1' ' A' ' 41' ' ' GLU . 0.7 OUTLIER -119.98 58.7 0.9 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.013 -179.729 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 190' ' ' TYR . . . . . 0.522 ' HB3' ' HG3' ' A' ' 38' ' ' LYS . 2.4 p90 -79.74 174.0 12.03 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.045 -179.832 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 191' ' ' THR . . . . . 0.552 ' HB ' ' HG2' ' A' ' 69' ' ' PRO . 0.6 OUTLIER -42.88 142.11 0.97 Allowed 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.292 179.729 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 192' ' ' CYS . . . . . 0.816 ' O ' HG22 ' A' ' 8' ' ' THR . 0.0 OUTLIER -90.13 168.66 11.8 Favored 'General case' 0 CA--C 1.498 -1.036 0 CA-C-O 121.959 0.885 . . . . 0.0 111.467 179.687 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 193' ' ' CYS . . . . . 0.704 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.1 OUTLIER 44.67 178.26 0.0 OUTLIER Pre-proline 0 C--N 1.314 -0.972 0 CA-C-N 113.048 -1.887 . . . . 0.0 112.954 173.622 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 194' ' ' PRO . . . . . 0.599 ' O ' HG21 ' A' ' 8' ' ' THR . 95.2 Cg_endo -86.75 -178.62 2.68 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.815 2.343 . . . . 0.0 112.706 -179.469 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -116.09 -69.48 0.85 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.296 -179.858 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 196' ' ' THR . . . . . 0.601 ' C ' ' H ' ' B' ' 198' ' ' TYR . 12.8 t -143.05 40.79 0.34 Allowed Pre-proline 0 C--N 1.33 -0.256 0 N-CA-C 112.376 0.509 . . . . 0.0 112.376 -179.449 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 197' ' ' PRO . . . . . 0.526 ' CD ' ' N ' ' B' ' 196' ' ' THR . 73.8 Cg_endo -74.38 17.79 0.51 Allowed 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 121.52 1.48 . . . . 0.0 108.987 175.953 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 198' ' ' TYR . . . . . 0.601 ' H ' ' C ' ' B' ' 196' ' ' THR . 77.9 t80 . . . . . 0 C--O 1.249 1.079 0 CA-C-N 113.994 -1.457 . . . . 0.0 111.272 -178.915 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' ILE . . . . . 0.749 HG23 ' HA ' ' A' ' 62' ' ' THR . 27.2 mm . . . . . 0 N--CA 1.487 1.375 0 CA-C-O 120.899 0.38 . . . . 0.0 111.09 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 0.652 HG22 ' HA ' ' A' ' 15' ' ' THR . 1.1 p -174.98 178.81 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.033 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.612 ' H ' HG22 ' A' ' 2' ' ' VAL . 0.1 OUTLIER -127.0 92.23 3.49 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 120.636 0.255 . . . . 0.0 111.656 -179.527 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 4' ' ' HIS . . . . . 0.585 ' HA ' HG11 ' A' ' 14' ' ' VAL . 84.8 m-70 -39.58 147.22 0.08 Allowed 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.902 179.816 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' THR . . . . . 1.0 HG23 HG12 ' A' ' 14' ' ' VAL . 18.9 p -71.9 79.89 0.9 Allowed 'General case' 0 C--N 1.334 -0.085 0 CA-C-O 120.902 0.382 . . . . 0.0 111.411 -179.467 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.576 ' HA ' HD23 ' A' ' 42' ' ' LEU . 4.7 p 63.31 7.48 2.91 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.734 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.513 ' HB3' ' O ' ' A' ' 6' ' ' THR . . . 73.83 -55.62 0.66 Allowed 'General case' 0 N--CA 1.462 0.174 0 N-CA-C 111.909 0.336 . . . . 0.0 111.909 179.506 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.663 HG22 ' HA ' ' B' ' 191' ' ' THR . 33.9 p -30.03 130.19 0.09 Allowed 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 -179.539 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.456 ' HB3' ' HD2' ' A' ' 10' ' ' PRO . 0.5 OUTLIER 68.22 167.25 0.12 Allowed Pre-proline 0 C--N 1.331 -0.22 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.519 -179.771 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.456 ' HD2' ' HB3' ' A' ' 9' ' ' SER . 28.0 Cg_endo -60.57 -34.03 92.95 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.581 2.187 . . . . 0.0 111.795 179.759 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.429 HG12 ' O ' ' A' ' 10' ' ' PRO . 0.1 OUTLIER 47.86 -160.63 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.85 179.598 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.614 ' O ' HG13 ' A' ' 14' ' ' VAL . 1.5 p 170.11 -64.4 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 120.833 0.349 . . . . 0.0 110.591 -179.568 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.3 81.79 0.09 Allowed 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 179.234 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 1.0 HG12 HG23 ' A' ' 5' ' ' THR . 0.8 OUTLIER -127.7 151.32 34.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.289 -178.669 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.652 ' HA ' HG22 ' A' ' 2' ' ' VAL . 0.1 OUTLIER 160.4 82.01 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.158 179.317 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.554 ' HB2' ' HD2' ' A' ' 17' ' ' PRO . 0.8 OUTLIER -63.03 179.31 0.31 Allowed Pre-proline 0 CA--C 1.532 0.264 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 179.113 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.554 ' HD2' ' HB2' ' A' ' 16' ' ' CYS . 28.8 Cg_exo -33.81 114.25 0.08 OUTLIER 'Trans proline' 0 C--N 1.35 0.617 0 C-N-CA 122.662 2.241 . . . . 0.0 113.144 -179.208 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_exo -46.09 177.79 0.01 OUTLIER 'Trans proline' 0 C--N 1.35 0.608 0 C-N-CA 123.196 2.598 . . . . 0.0 113.33 -179.168 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 69.39 -158.72 53.23 Favored Glycine 0 N--CA 1.451 -0.345 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.981 -179.729 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -57.96 -166.18 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 110.209 -0.293 . . . . 0.0 110.209 179.424 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.576 ' CB ' ' HB2' ' A' ' 46' ' ' ALA . 0.0 OUTLIER 66.23 90.38 0.09 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.186 0.517 . . . . 0.0 109.724 -179.899 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.553 ' HB3' ' HB3' ' A' ' 60' ' ' CYS . 0.7 OUTLIER -112.52 178.12 4.4 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.315 0.578 . . . . 0.0 112.13 -178.9 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.574 ' O ' ' HB2' ' A' ' 60' ' ' CYS . 12.7 m -62.62 84.94 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.264 -0.88 . . . . 0.0 112.877 -178.278 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.531 ' HB3' ' HA ' ' A' ' 59' ' ' CYS . 40.0 p90 -68.09 70.24 0.15 Allowed 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.507 0.67 . . . . 0.0 109.298 178.153 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.463 ' N ' ' O ' ' A' ' 23' ' ' CYS . 0.0 OUTLIER -41.15 147.1 0.15 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.11 -0.95 . . . . 0.0 112.948 -178.347 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.496 ' CG ' HG13 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -130.48 171.89 12.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 114.974 -1.012 . . . . 0.0 109.547 179.065 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 2.3 ttp -160.53 -176.55 5.64 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.916 0.389 . . . . 0.0 111.574 -179.776 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' TRP . . . . . 0.492 ' HB2' ' CG2' ' A' ' 39' ' ' VAL . 0.4 OUTLIER -100.3 -164.35 1.11 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.246 -179.948 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER 69.7 -65.37 0.31 Allowed 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.809 -179.935 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 61.97 78.51 0.29 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.25 179.659 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . 48.89 45.01 22.53 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.447 179.631 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -152.23 -170.56 3.68 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.688 179.862 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 44.89 -170.76 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.448 179.822 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 47.7 t -89.58 -28.56 19.48 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.472 179.636 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.461 ' O ' ' N ' ' A' ' 37' ' ' GLY . 1.3 p -179.74 -49.58 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.796 179.814 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 30.87 -87.22 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.329 0.652 . . . . 0.0 112.496 179.614 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.461 ' N ' ' O ' ' A' ' 35' ' ' SER . . . 62.05 -105.76 1.03 Allowed Glycine 0 C--N 1.332 0.347 0 C-N-CA 120.508 -0.853 . . . . 0.0 112.781 179.795 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.487 ' HA ' ' HD2' ' A' ' 38' ' ' LYS . 0.4 OUTLIER 45.26 43.6 8.26 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 121.174 0.511 . . . . 0.0 111.745 179.944 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.492 ' CG2' ' HB2' ' A' ' 28' ' ' TRP . 3.3 t -137.68 105.46 3.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.136 178.656 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.963 HG11 ' HB ' ' B' ' 191' ' ' THR . 12.1 p -110.83 163.4 7.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-O 121.231 0.538 . . . . 0.0 112.354 -178.198 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.531 ' N ' HG22 ' A' ' 40' ' ' VAL . 0.3 OUTLIER -164.66 -123.71 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.408 -179.975 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.59 HD12 ' N ' ' A' ' 43' ' ' GLY . 1.0 OUTLIER -169.79 -57.24 0.02 OUTLIER 'General case' 0 C--O 1.233 0.188 0 CA-C-N 118.101 0.41 . . . . 0.0 110.976 179.314 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.59 ' N ' HD12 ' A' ' 42' ' ' LEU . . . 96.35 -109.66 3.89 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.746 -0.74 . . . . 0.0 113.108 179.673 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.493 ' HA ' ' O ' ' A' ' 22' ' ' LEU . 52.5 t 74.72 88.01 0.09 Allowed 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.998 0.427 . . . . 0.0 110.503 -178.94 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.408 ' CB ' ' CE1' ' A' ' 24' ' ' TYR . . . -164.68 146.37 8.18 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.729 -0.668 . . . . 0.0 111.12 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.576 ' HB2' ' CB ' ' A' ' 21' ' ' ASN . . . -121.64 76.99 1.31 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.089 -179.796 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.797 HG23 ' HD3' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -172.49 -38.82 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.008 -179.888 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.414 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 5.7 m 59.41 52.32 3.78 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.396 179.532 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.797 ' HD3' HG23 ' A' ' 47' ' ' THR . 59.6 Cg_endo -71.97 -9.82 25.22 Favored 'Trans proline' 0 C--N 1.343 0.266 0 C-N-CA 122.315 2.01 . . . . 0.0 111.578 179.004 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 6.8 t -55.51 140.45 40.46 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.143 179.797 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -168.26 33.66 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.678 179.899 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.419 ' HB3' ' HD2' ' A' ' 53' ' ' PRO . 1.4 mttm -81.98 158.48 67.39 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.668 -179.887 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' PRO . . . . . 0.419 ' HD2' ' HB3' ' A' ' 52' ' ' LYS . 12.7 Cg_endo -56.35 -70.48 0.04 OUTLIER 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.527 2.151 . . . . 0.0 112.13 179.93 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' TYR . . . . . 0.406 ' CZ ' ' HG2' ' A' ' 53' ' ' PRO . 0.0 OUTLIER -70.76 -80.55 0.05 Allowed 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.132 -179.906 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 42.24 -155.26 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.575 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.5 tp10 -175.05 -38.26 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.347 0 CA-C-O 120.687 0.279 . . . . 0.0 111.297 -179.341 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.496 HG13 ' CG ' ' A' ' 26' ' ' LYS . 29.5 m -49.36 149.92 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.993 0.425 . . . . 0.0 111.785 -179.545 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 3.8 t -147.55 20.42 1.18 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.876 179.651 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' CYS . . . . . 0.531 ' HA ' ' HB3' ' A' ' 24' ' ' TYR . 1.3 m 62.1 124.09 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.975 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.574 ' HB2' ' O ' ' A' ' 23' ' ' CYS . 4.6 t -84.91 -52.65 5.85 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.103 -179.679 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 53.09 99.62 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.314 179.646 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.749 ' HA ' HG23 ' A' ' 1' ' ' ILE . 46.7 p 40.69 96.66 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.902 179.689 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ASP . . . . . 0.44 ' O ' ' CG ' ' A' ' 64' ' ' LYS . 1.0 OUTLIER 178.26 -13.14 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 179.634 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.473 ' O ' ' C ' ' A' ' 65' ' ' CYS . 3.8 ptmm? 46.65 31.75 1.48 Allowed 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 120.742 0.306 . . . . 0.0 110.839 -179.405 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' CYS . . . . . 0.473 ' C ' ' O ' ' A' ' 64' ' ' LYS . 0.1 OUTLIER -17.0 -65.36 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 115.459 -0.791 . . . . 0.0 112.674 -179.757 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 58.9 t30 76.5 92.21 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.307 -179.848 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' PRO . . . . . 0.652 ' HB2' HG23 ' A' ' 40' ' ' VAL . 12.8 Cg_exo -69.4 -171.62 0.46 Allowed 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.759 2.306 . . . . 0.0 112.109 179.83 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 7.4 p80 176.71 158.57 0.46 Allowed Pre-proline 0 C--N 1.331 -0.224 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.839 179.805 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.489 ' HG3' HG23 ' B' ' 191' ' ' THR . 45.1 Cg_exo -55.57 136.35 73.63 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.509 2.139 . . . . 0.0 112.139 179.908 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.424 ' HG2' ' O ' ' A' ' 35' ' ' SER . 0.4 OUTLIER -92.79 -50.62 5.48 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.44 179.812 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.419 ' CB ' ' HG2' ' A' ' 38' ' ' LYS . 42.4 tp60 -77.81 55.5 1.39 Allowed 'General case' 0 C--O 1.232 0.175 0 CA-C-O 120.846 0.355 . . . . 0.0 111.004 179.763 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.603 ' N ' ' CD ' ' A' ' 73' ' ' PRO . 1.3 ptp180 -93.89 -30.33 0.29 Allowed Pre-proline 0 CA--C 1.536 0.438 0 N-CA-C 112.551 0.575 . . . . 0.0 112.551 -179.682 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.603 ' CD ' ' N ' ' A' ' 72' ' ' ARG . 89.3 Cg_endo -83.57 99.52 0.84 Allowed 'Trans proline' 0 C--N 1.35 0.636 0 C-N-CA 121.961 1.774 . . . . 0.0 112.41 -179.738 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.367 -1.241 . . . . 0.0 112.5 -179.995 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 181' ' ' TYR . . . . . 0.441 ' O ' ' HB3' ' B' ' 182' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.584 0 N-CA-C 111.367 0.136 . . . . 0.0 111.367 . . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 182' ' ' ARG . . . . . 0.441 ' HB3' ' O ' ' B' ' 181' ' ' TYR . 14.7 tpt180 69.58 -65.35 0.31 Allowed 'General case' 0 C--O 1.232 0.158 0 CA-C-O 120.688 0.28 . . . . 0.0 110.816 -179.729 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 183' ' ' GLY . . . . . . . . . . . . . . . -64.43 145.09 49.29 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.34 179.88 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 184' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -118.24 -39.31 3.06 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.758 0.313 . . . . 0.0 110.971 -179.834 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 185' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -120.59 158.02 28.26 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.072 -179.859 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 186' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -146.43 -164.39 1.96 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.649 179.892 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 187' ' ' TRP . . . . . . . . . . . . . 34.4 m95 -75.69 159.11 31.48 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.922 0.391 . . . . 0.0 111.0 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 188' ' ' VAL . . . . . 0.632 HG22 ' N ' ' B' ' 189' ' ' TYR . 0.2 OUTLIER -80.3 -81.32 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.68 179.913 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 189' ' ' TYR . . . . . 0.632 ' N ' HG22 ' B' ' 188' ' ' VAL . 1.7 m-85 -130.06 126.96 38.9 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.782 0.325 . . . . 0.0 110.367 179.675 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 190' ' ' TYR . . . . . 0.454 ' CZ ' ' HE3' ' A' ' 38' ' ' LYS . 0.3 OUTLIER -138.28 115.99 11.42 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.154 0.502 . . . . 0.0 111.359 -179.542 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 191' ' ' THR . . . . . 0.963 ' HB ' HG11 ' A' ' 40' ' ' VAL . 1.0 OUTLIER -90.61 44.31 1.19 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.565 179.201 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 192' ' ' CYS . . . . . 0.697 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.0 OUTLIER -52.72 172.37 0.05 OUTLIER 'General case' 0 CA--C 1.497 -1.073 0 CA-C-O 121.884 0.85 . . . . 0.0 111.587 -179.872 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 193' ' ' CYS . . . . . 0.697 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.1 OUTLIER 43.14 81.65 0.24 Allowed Pre-proline 0 N--CA 1.439 -1.003 0 CA-C-N 113.452 -1.704 . . . . 0.0 112.161 173.75 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 194' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -86.44 30.67 0.48 Allowed 'Trans proline' 0 N--CA 1.461 -0.384 0 C-N-CA 123.054 2.503 . . . . 0.0 112.781 -179.878 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -162.45 71.57 0.32 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.876 0.369 . . . . 0.0 110.664 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 196' ' ' THR . . . . . 0.657 ' N ' ' HD3' ' B' ' 197' ' ' PRO . 65.2 p -143.36 47.93 0.88 Allowed Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.871 -179.875 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 197' ' ' PRO . . . . . 0.657 ' HD3' ' N ' ' B' ' 196' ' ' THR . 6.3 Cg_exo -73.95 13.5 0.8 Allowed 'Trans proline' 0 C--N 1.351 0.683 0 C-N-CA 121.674 1.583 . . . . 0.0 108.742 175.941 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 198' ' ' TYR . . . . . 0.596 ' H ' ' C ' ' B' ' 196' ' ' THR . 63.9 t80 . . . . . 0 C--O 1.249 1.049 0 CA-C-N 113.929 -1.487 . . . . 0.0 111.291 -178.803 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' ILE . . . . . 0.539 HG23 ' H ' ' A' ' 2' ' ' VAL . 2.1 tp . . . . . 0 N--CA 1.486 1.37 0 CA-C-O 120.593 0.235 . . . . 0.0 111.1 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 0.704 HG23 HG22 ' A' ' 15' ' ' THR . 0.5 OUTLIER -178.97 -169.04 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.566 -0.288 . . . . 0.0 110.792 -179.933 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.634 ' N ' HG13 ' A' ' 2' ' ' VAL . 0.9 OUTLIER -147.16 -50.26 0.19 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.712 0.291 . . . . 0.0 111.302 179.971 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 4' ' ' HIS . . . . . 0.453 ' O ' ' ND2' ' A' ' 66' ' ' ASN . 6.7 p-80 53.95 110.28 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.244 0.545 . . . . 0.0 111.029 -179.591 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.54 HG22 HG13 ' A' ' 14' ' ' VAL . 1.9 t -82.7 109.95 17.33 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.552 -179.029 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.624 HG23 ' HB3' ' A' ' 10' ' ' PRO . 4.0 m -93.55 17.77 11.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.356 179.659 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -59.76 84.78 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.785 0.326 . . . . 0.0 110.93 179.919 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 2.2 p 60.44 19.07 8.78 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.896 -179.711 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 2.5 p 168.8 104.29 0.04 OUTLIER Pre-proline 0 C--O 1.232 0.137 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.823 -179.914 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.752 ' O ' HG22 ' A' ' 11' ' ' ILE . 23.3 Cg_endo -85.69 -136.34 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.704 2.269 . . . . 0.0 111.45 179.804 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.752 HG22 ' O ' ' A' ' 10' ' ' PRO . 1.3 tt 55.27 0.08 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.286 0 N-CA-C 113.126 0.787 . . . . 0.0 113.126 179.616 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.48 ' H ' ' C ' ' A' ' 10' ' ' PRO . 0.1 OUTLIER -67.89 -43.74 78.62 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.761 0.315 . . . . 0.0 111.297 -179.504 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.798 ' O ' HG23 ' A' ' 15' ' ' THR . . . 58.99 44.42 16.36 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.005 0.431 . . . . 0.0 110.767 -179.639 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.54 HG13 HG22 ' A' ' 5' ' ' THR . 16.1 m -54.01 -39.13 39.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.366 -179.803 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.798 HG23 ' O ' ' A' ' 13' ' ' ALA . 1.8 p 62.71 147.76 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.893 -179.924 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.408 ' N ' ' HD3' ' A' ' 17' ' ' PRO . 6.8 t -128.53 57.63 29.68 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.599 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.613 ' N ' ' HD2' ' A' ' 18' ' ' PRO . 74.2 Cg_exo -47.0 -50.06 11.55 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.656 2.238 . . . . 0.0 112.981 179.592 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.613 ' HD2' ' N ' ' A' ' 17' ' ' PRO . 11.2 Cg_endo -55.37 -62.14 0.3 Allowed 'Trans proline' 0 C--N 1.349 0.575 0 C-N-CA 122.345 2.03 . . . . 0.0 112.498 -179.649 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.497 ' HA2' ' HA ' ' A' ' 46' ' ' ALA . . . -45.99 156.7 0.45 Allowed Glycine 0 C--N 1.331 0.25 0 C-N-CA 120.823 -0.703 . . . . 0.0 112.459 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.916 ' HG3' HD11 ' A' ' 22' ' ' LEU . 0.0 OUTLIER -99.4 48.96 0.94 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.031 0.444 . . . . 0.0 112.128 -179.314 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.547 ' C ' HD13 ' A' ' 22' ' ' LEU . 0.3 OUTLIER 77.72 60.52 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.744 -0.662 . . . . 0.0 112.441 178.357 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.916 HD11 ' HG3' ' A' ' 20' ' ' GLU . 0.0 OUTLIER -152.13 96.7 2.22 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 121.003 0.43 . . . . 0.0 111.605 178.366 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.562 ' HA ' ' HA ' ' A' ' 44' ' ' CYS . 9.5 m -87.77 44.81 1.22 Allowed 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.825 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.663 ' CD2' HG11 ' A' ' 57' ' ' VAL . 0.2 OUTLIER 35.29 -89.31 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 179.535 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.605 ' CB ' ' O ' ' A' ' 24' ' ' TYR . 12.5 ttm-85 107.08 -59.69 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.331 0.652 . . . . 0.0 111.835 -179.959 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.831 ' CA ' HG12 ' A' ' 57' ' ' VAL . 0.7 OUTLIER 61.53 123.89 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.541 -179.048 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 10.0 ptt? -144.41 137.59 27.13 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.003 0.43 . . . . 0.0 111.87 -179.65 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' TRP . . . . . 0.452 ' HB3' HG21 ' A' ' 39' ' ' VAL . 4.3 t90 -136.41 142.54 43.69 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.426 179.399 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' CYS . . . . . 0.476 ' HA ' ' CB ' ' A' ' 33' ' ' CYS . 33.8 t 69.94 11.13 7.67 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.51 -179.822 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -97.97 44.82 1.03 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.778 0.323 . . . . 0.0 111.072 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -178.3 -88.32 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.983 179.753 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -96.63 76.47 2.85 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.996 0.427 . . . . 0.0 110.077 179.526 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.476 ' CB ' ' HA ' ' A' ' 29' ' ' CYS . 7.2 t -161.15 156.49 24.43 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.798 -179.119 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -51.35 -54.3 27.73 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.96 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 2.6 m -86.43 168.29 13.91 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.614 179.755 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.419 ' CG ' ' O ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -100.51 63.12 1.08 Allowed 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.363 -179.637 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.446 ' N ' ' O ' ' A' ' 29' ' ' CYS . . . 78.46 144.26 2.47 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.436 -0.887 . . . . 0.0 113.118 179.498 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.59 ' HA ' ' HG2' ' A' ' 70' ' ' LYS . 0.0 OUTLIER 179.19 33.25 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.333 0.587 . . . . 0.0 109.83 179.574 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.452 HG21 ' HB3' ' A' ' 28' ' ' TRP . 46.2 t -143.27 134.54 23.22 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-N 115.295 -0.866 . . . . 0.0 110.128 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.623 HG12 ' CD2' ' A' ' 42' ' ' LEU . 0.1 OUTLIER -144.99 159.76 13.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 120.922 0.392 . . . . 0.0 111.328 -179.334 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.457 ' CB ' ' CB ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -157.19 42.81 0.34 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.12 -179.999 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.623 ' CD2' HG12 ' A' ' 40' ' ' VAL . 4.2 mm? -51.19 153.03 2.13 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.571 179.721 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 158.87 -6.04 0.14 Allowed Glycine 0 CA--C 1.52 0.345 0 C-N-CA 120.1 -1.048 . . . . 0.0 113.74 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.562 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 52.5 t 61.32 152.88 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 117.602 0.701 . . . . 0.0 111.496 179.752 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.574 ' O ' ' HB2' ' A' ' 46' ' ' ALA . . . -128.06 -79.37 0.58 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.743 179.745 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.575 ' CA ' HD21 ' A' ' 22' ' ' LEU . . . 168.01 -24.98 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.874 179.699 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 14.8 t -146.1 134.19 21.55 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.766 0.317 . . . . 0.0 111.438 -179.449 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.489 ' O ' ' N ' ' A' ' 50' ' ' SER . 11.3 m -78.99 -47.11 1.69 Allowed Pre-proline 0 C--N 1.333 -0.142 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.732 179.552 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.486 ' HD3' ' HB2' ' A' ' 48' ' ' CYS . 17.3 Cg_exo -65.97 59.76 0.44 Allowed 'Trans proline' 0 C--N 1.349 0.585 0 C-N-CA 122.335 2.024 . . . . 0.0 110.374 178.701 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.489 ' N ' ' O ' ' A' ' 48' ' ' CYS . 23.0 t -93.65 -41.23 9.83 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 115.231 -0.895 . . . . 0.0 111.018 -178.615 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.528 ' O ' ' CB ' ' A' ' 52' ' ' LYS . 4.3 mmtm -141.47 -80.12 0.25 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.712 179.747 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.71 ' HB2' ' HD3' ' A' ' 53' ' ' PRO . 4.9 mtpp 107.29 -56.92 0.0 OUTLIER Pre-proline 0 N--CA 1.474 0.759 0 C-N-CA 123.954 0.902 . . . . 0.0 111.355 179.735 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' PRO . . . . . 0.71 ' HD3' ' HB2' ' A' ' 52' ' ' LYS . 39.4 Cg_exo -59.83 -156.65 0.02 OUTLIER 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 122.06 1.84 . . . . 0.0 111.971 179.641 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.84 85.59 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.598 179.691 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 13.1 tt0 -106.9 -91.14 0.42 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.256 -179.704 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 174.59 -50.18 0.01 OUTLIER 'General case' 0 N--CA 1.456 -0.141 0 CA-C-O 121.004 0.431 . . . . 0.0 110.47 -179.509 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.831 HG12 ' CA ' ' A' ' 26' ' ' LYS . 30.1 m -92.54 178.24 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 115.844 -0.617 . . . . 0.0 111.554 -179.644 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.535 HG23 ' O ' ' A' ' 57' ' ' VAL . 0.4 OUTLIER -167.3 33.6 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.441 179.88 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 2.7 m 68.99 168.04 0.28 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.581 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.499 ' HB3' ' HB2' ' A' ' 23' ' ' CYS . 0.1 OUTLIER -162.18 36.14 0.12 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.742 0.306 . . . . 0.0 111.495 -179.374 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.549 ' C ' HG23 ' A' ' 62' ' ' THR . 0.1 OUTLIER -74.72 -163.0 0.18 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.655 0.264 . . . . 0.0 111.222 -179.916 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.549 HG23 ' C ' ' A' ' 61' ' ' SER . 1.4 p 77.71 27.99 0.58 Allowed 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.224 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 16.2 t70 60.68 149.66 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.572 179.288 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.45 ' HA ' ' CE1' ' A' ' 4' ' ' HIS . 0.0 OUTLIER 29.53 87.39 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 115.631 -0.713 . . . . 0.0 112.517 179.57 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 65' ' ' CYS . . . . . 0.432 ' CB ' ' O ' ' A' ' 60' ' ' CYS . 49.0 t -123.4 -10.49 7.97 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.297 179.77 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.54 ' N ' ' HD2' ' A' ' 67' ' ' PRO . 12.3 m-80 -63.07 -57.06 22.87 Favored Pre-proline 0 CA--C 1.531 0.236 0 CA-C-N 116.578 -0.283 . . . . 0.0 111.534 -179.913 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 67' ' ' PRO . . . . . 0.54 ' HD2' ' N ' ' A' ' 66' ' ' ASN . 1.3 Cg_endo -42.83 165.4 0.03 OUTLIER 'Trans proline' 0 C--N 1.349 0.58 0 C-N-CA 122.992 2.461 . . . . 0.0 112.94 -179.65 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.52 ' N ' ' HD3' ' A' ' 69' ' ' PRO . 2.2 m-70 57.57 51.81 5.08 Favored Pre-proline 0 C--N 1.331 -0.197 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.064 -179.801 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.52 ' HD3' ' N ' ' A' ' 68' ' ' HIS . 96.6 Cg_endo -86.63 -47.6 0.04 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.595 0 C-N-CA 122.479 2.12 . . . . 0.0 113.105 -179.697 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.59 ' HG2' ' HA ' ' A' ' 38' ' ' LYS . 0.0 OUTLIER -179.01 -164.12 0.07 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.662 -179.051 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 56.94 -82.07 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 111.7 0.259 . . . . 0.0 111.7 179.441 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.428 ' N ' ' O ' ' A' ' 70' ' ' LYS . 15.0 ptp180 -57.49 146.13 65.49 Favored Pre-proline 0 C--N 1.33 -0.241 0 CA-C-O 120.627 0.251 . . . . 0.0 111.182 -179.526 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -58.89 83.34 0.05 OUTLIER 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.613 2.209 . . . . 0.0 112.113 179.868 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.031 0 CA-C-O 118.363 -1.243 . . . . 0.0 112.381 -179.905 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 181' ' ' TYR . . . . . . . . . . . . . 88.3 t80 . . . . . 0 N--CA 1.486 1.359 0 CA-C-O 120.75 0.31 . . . . 0.0 111.134 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 182' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -74.0 70.68 1.53 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.956 179.959 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 183' ' ' GLY . . . . . . . . . . . . . . . -136.09 178.89 18.39 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.391 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 184' ' ' TRP . . . . . . . . . . . . . 4.6 m95 59.52 100.14 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.787 0.327 . . . . 0.0 110.859 -179.944 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 185' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -140.77 -46.43 0.4 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.847 -179.895 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 186' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -117.14 104.23 11.01 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.953 179.959 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 187' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -62.23 -150.3 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.536 179.821 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 188' ' ' VAL . . . . . 0.421 ' HB ' ' CE1' ' B' ' 190' ' ' TYR . 0.2 OUTLIER -79.43 172.35 1.14 Allowed 'Isoleucine or valine' 0 N--CA 1.456 -0.169 0 CA-C-O 120.823 0.344 . . . . 0.0 110.941 -179.85 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 189' ' ' TYR . . . . . 0.401 ' H ' HG12 ' B' ' 188' ' ' VAL . 80.1 m-85 -85.75 136.98 33.12 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.249 -179.746 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 190' ' ' TYR . . . . . 0.447 ' CE2' ' HB2' ' A' ' 38' ' ' LYS . 24.3 m-85 -139.83 122.32 16.17 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.689 179.755 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 191' ' ' THR . . . . . 0.601 HG22 ' O ' ' B' ' 191' ' ' THR . 85.8 m -89.66 49.38 1.73 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.19 0.519 . . . . 0.0 111.177 179.885 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 192' ' ' CYS . . . . . 0.697 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.0 OUTLIER -90.07 172.56 8.75 Favored 'General case' 0 CA--C 1.498 -1.029 0 CA-C-O 121.752 0.787 . . . . 0.0 110.985 179.561 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 193' ' ' CYS . . . . . 0.697 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.1 OUTLIER 41.31 73.36 0.9 Allowed Pre-proline 0 C--N 1.314 -0.946 0 CA-C-N 113.625 -1.625 . . . . 0.0 112.172 173.706 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 194' ' ' PRO . . . . . 0.413 ' HB3' ' CG2' ' A' ' 6' ' ' THR . 36.2 Cg_endo -65.06 -87.42 0.0 OUTLIER 'Trans proline' 0 CA--C 1.531 0.331 0 C-N-CA 122.555 2.17 . . . . 0.0 112.391 -179.749 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 30.9 t0 -106.14 13.64 28.74 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.566 0.222 . . . . 0.0 111.539 -179.805 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 196' ' ' THR . . . . . 0.762 ' C ' ' H ' ' B' ' 198' ' ' TYR . 77.3 p -79.89 -22.32 0.36 Allowed Pre-proline 0 C--N 1.331 -0.208 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 179.951 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 197' ' ' PRO . . . . . 0.664 ' CD ' ' N ' ' B' ' 196' ' ' THR . 17.2 Cg_exo -64.73 27.87 0.08 OUTLIER 'Trans proline' 0 C--N 1.355 0.878 0 C-N-CA 121.329 1.353 . . . . 0.0 109.622 177.172 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 198' ' ' TYR . . . . . 0.762 ' H ' ' C ' ' B' ' 196' ' ' THR . 13.0 t80 . . . . . 0 C--O 1.249 1.026 0 CA-C-N 114.283 -1.326 . . . . 0.0 111.28 -178.739 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 1' ' ' ILE . . . . . 0.534 HG21 ' C ' ' A' ' 62' ' ' THR . 1.2 mm . . . . . 0 N--CA 1.487 1.419 0 CA-C-O 120.758 0.313 . . . . 0.0 110.781 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 0.814 ' CG2' HG22 ' A' ' 15' ' ' THR . 1.0 OUTLIER -96.41 146.95 6.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.921 -179.818 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 29.2 p -127.0 116.45 20.78 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 112.37 0.507 . . . . 0.0 112.37 -178.68 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' HIS . . . . . 0.746 ' HA ' ' HA ' ' A' ' 14' ' ' VAL . 0.0 OUTLIER -46.35 166.3 0.02 OUTLIER 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.278 179.163 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.731 HG23 ' O ' ' A' ' 13' ' ' ALA . 21.2 p -88.91 126.09 35.23 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.924 -179.843 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -121.04 28.82 7.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.069 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -48.26 -30.36 4.71 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 121.018 0.437 . . . . 0.0 111.046 179.797 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 88.0 m -165.61 -68.96 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.239 179.702 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.461 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER -102.75 169.39 7.56 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.173 179.506 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.55 ' HG3' ' CA ' ' B' ' 195' ' ' ASP . 9.7 Cg_endo -51.64 -47.54 25.79 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.365 2.043 . . . . 0.0 111.893 179.672 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.561 HG22 ' N ' ' A' ' 12' ' ' SER . 31.1 mm 64.14 -103.05 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.982 179.838 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.561 ' N ' HG22 ' A' ' 11' ' ' ILE . 4.1 t 162.95 -35.12 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.779 0.323 . . . . 0.0 110.79 179.892 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.731 ' O ' HG23 ' A' ' 5' ' ' THR . . . -57.81 111.12 1.05 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.658 -179.511 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.746 ' HA ' ' HA ' ' A' ' 4' ' ' HIS . 0.1 OUTLIER -97.66 169.19 1.52 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.727 179.674 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.814 HG22 ' CG2' ' A' ' 2' ' ' VAL . 1.2 p 74.59 158.28 0.2 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.595 -179.967 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.471 ' O ' ' HD3' ' A' ' 18' ' ' PRO . 0.0 OUTLIER 176.54 -48.76 0.0 OUTLIER Pre-proline 0 C--N 1.327 -0.379 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.225 -179.868 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.448 ' HB3' ' O ' ' A' ' 21' ' ' ASN . 69.3 Cg_endo -98.46 78.72 0.06 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.721 0 C-N-CA 123.111 2.541 . . . . 0.0 113.723 -178.448 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.471 ' HD3' ' O ' ' A' ' 16' ' ' CYS . 49.3 Cg_endo -68.56 162.86 39.1 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.013 1.809 . . . . 0.0 111.106 178.808 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 53.26 -88.45 0.01 OUTLIER Glycine 0 CA--C 1.519 0.295 0 C-N-CA 120.528 -0.844 . . . . 0.0 112.518 -179.866 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.433 ' N ' ' O ' ' A' ' 18' ' ' PRO . 14.5 mt-10 -140.07 111.82 7.41 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.807 0.337 . . . . 0.0 110.884 179.842 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.493 ' O ' ' C ' ' A' ' 22' ' ' LEU . 0.3 OUTLIER -178.5 34.09 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.081 179.904 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.789 HD23 ' O ' ' A' ' 47' ' ' THR . 0.2 OUTLIER -12.85 124.94 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 -179.822 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.746 ' HB3' HD21 ' A' ' 42' ' ' LEU . 0.1 OUTLIER -43.65 -29.41 0.5 Allowed 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.898 -179.691 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.509 ' CD2' ' HB2' ' A' ' 45' ' ' ALA . 0.2 OUTLIER 60.58 126.4 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.997 0.427 . . . . 0.0 111.344 179.51 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 3.0 ttt180 -117.21 78.06 1.18 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.801 179.75 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.529 ' HG2' HG12 ' A' ' 57' ' ' VAL . 2.9 mtmm -64.67 154.55 36.2 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.13 -179.83 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 1.8 ttm -157.5 100.45 1.8 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.52 179.862 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' TRP . . . . . 0.579 ' HE3' HG11 ' A' ' 39' ' ' VAL . 0.8 OUTLIER -56.42 -36.74 69.3 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.476 -179.544 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER 59.63 -168.4 0.15 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.826 0.346 . . . . 0.0 110.72 179.914 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 26.7 p-10 -91.71 -38.3 12.49 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.816 179.847 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -171.93 -56.08 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.809 179.855 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -131.96 17.48 4.64 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.974 179.58 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 93.0 m 56.84 165.76 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.945 0.402 . . . . 0.0 111.337 179.755 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 11.4 p 172.13 -34.16 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.499 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -161.36 -43.74 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.584 179.937 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.53 -172.22 1.75 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.967 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.472 ' O ' ' N ' ' A' ' 39' ' ' VAL . . . 169.69 -38.62 0.2 Allowed Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 121.141 -0.552 . . . . 0.0 111.887 -179.844 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.634 ' HA ' ' HB2' ' A' ' 70' ' ' LYS . 0.0 OUTLIER 22.92 -83.12 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 113.534 0.938 . . . . 0.0 113.534 179.673 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.715 ' HA ' ' O ' ' B' ' 189' ' ' TYR . 11.2 t -38.7 118.62 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 N-CA-C 112.664 0.616 . . . . 0.0 112.664 -178.617 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.563 HG13 ' O ' ' A' ' 38' ' ' LYS . 35.3 m -115.0 171.64 4.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.02 -179.83 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -173.96 33.96 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.339 179.901 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.878 HD12 ' HG3' ' A' ' 67' ' ' PRO . 0.6 OUTLIER -68.83 139.49 55.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.313 179.476 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 160.54 40.32 0.02 OUTLIER Glycine 0 C--N 1.332 0.354 0 C-N-CA 119.911 -1.138 . . . . 0.0 113.241 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.581 ' N ' ' O ' ' A' ' 23' ' ' CYS . 13.7 m 60.61 152.56 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.075 0.464 . . . . 0.0 111.659 179.045 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.525 ' O ' ' HB2' ' A' ' 46' ' ' ALA . . . -133.0 -77.97 0.49 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.997 179.96 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.525 ' HB2' ' O ' ' A' ' 45' ' ' ALA . . . 170.75 -31.26 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.347 179.924 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.789 ' O ' HD23 ' A' ' 22' ' ' LEU . 13.5 t -141.35 -165.55 1.99 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.345 -179.686 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.547 ' H ' ' HD2' ' A' ' 49' ' ' PRO . 34.5 t -148.03 -60.46 0.02 OUTLIER Pre-proline 0 C--N 1.331 -0.205 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.494 -179.993 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.547 ' HD2' ' H ' ' A' ' 48' ' ' CYS . 3.4 Cg_exo -39.66 -26.83 0.17 Allowed 'Trans proline' 0 C--N 1.353 0.77 0 C-N-CA 122.519 2.146 . . . . 0.0 111.52 179.083 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.477 ' HB2' HG23 ' A' ' 47' ' ' THR . 0.9 OUTLIER -41.47 136.05 1.89 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.42 178.708 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 170.63 59.81 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.915 0.388 . . . . 0.0 111.043 179.62 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.525 ' HB2' ' HD3' ' A' ' 53' ' ' PRO . 0.0 OUTLIER -97.14 -67.07 0.07 OUTLIER Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.101 179.878 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 53' ' ' PRO . . . . . 0.525 ' HD3' ' HB2' ' A' ' 52' ' ' LYS . 72.2 Cg_endo -76.14 166.52 27.66 Favored 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 122.132 1.888 . . . . 0.0 112.286 179.907 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -73.76 84.0 1.64 Allowed 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.935 179.998 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.407 ' CG ' ' HG2' ' A' ' 53' ' ' PRO . 0.6 OUTLIER -111.79 -138.41 0.38 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.048 -179.936 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.625 ' O ' HG22 ' A' ' 57' ' ' VAL . 0.5 OUTLIER -139.3 -102.48 0.17 Allowed 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.853 -179.51 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.625 HG22 ' O ' ' A' ' 56' ' ' GLU . 20.9 m 49.61 159.88 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.391 0 CA-C-O 121.376 0.607 . . . . 0.0 112.426 179.785 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -149.59 17.84 0.91 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.075 179.86 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 7.8 t 49.61 97.47 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.719 179.674 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.407 ' HB3' ' HB3' ' A' ' 23' ' ' CYS . 21.1 t -84.71 -108.71 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 179.162 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.67 ' CB ' HD12 ' A' ' 22' ' ' LEU . 2.8 p 69.62 -59.22 0.5 Allowed 'General case' 0 N--CA 1.463 0.191 0 N-CA-C 111.955 0.354 . . . . 0.0 111.955 179.187 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.534 ' C ' HG21 ' A' ' 1' ' ' ILE . 23.8 p -51.56 -173.55 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.938 0.399 . . . . 0.0 111.6 -179.403 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ASP . . . . . 0.468 ' N ' HG21 ' A' ' 1' ' ' ILE . 2.0 p30 -39.88 160.1 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.754 -179.56 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 29.6 mtpt -40.73 92.49 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.484 -179.619 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' CYS . . . . . 0.438 ' N ' ' O ' ' A' ' 63' ' ' ASP . 4.1 m -38.75 -40.78 0.65 Allowed 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.247 -179.914 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 2.2 m120 43.23 55.29 11.21 Favored Pre-proline 0 N--CA 1.463 0.196 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.577 179.621 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' PRO . . . . . 0.878 ' HG3' HD12 ' A' ' 42' ' ' LEU . 58.9 Cg_endo -71.6 -8.32 22.97 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.424 2.083 . . . . 0.0 112.532 179.935 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 21.7 m170 60.19 158.83 0.11 Allowed Pre-proline 0 C--N 1.332 -0.189 0 CA-C-N 116.53 -0.304 . . . . 0.0 110.591 -179.835 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.509 ' HA ' ' OG1' ' B' ' 191' ' ' THR . 67.1 Cg_exo -43.65 -66.43 0.16 Allowed 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.601 2.201 . . . . 0.0 113.106 -179.45 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.634 ' HB2' ' HA ' ' A' ' 38' ' ' LYS . 0.0 OUTLIER -134.73 178.91 6.64 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 120.645 0.26 . . . . 0.0 110.939 -179.408 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.53 ' O ' ' HD2' ' A' ' 72' ' ' ARG . 14.5 tp60 -115.44 -11.24 11.86 Favored 'General case' 0 N--CA 1.463 0.218 0 N-CA-C 111.915 0.339 . . . . 0.0 111.915 -179.597 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.53 ' HD2' ' O ' ' A' ' 71' ' ' GLN . 0.0 OUTLIER 48.43 168.14 0.03 OUTLIER Pre-proline 0 N--CA 1.466 0.344 0 CA-C-O 121.1 0.476 . . . . 0.0 112.075 179.855 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.413 ' CD ' ' HB2' ' A' ' 72' ' ' ARG . 17.1 Cg_exo -67.52 136.22 38.84 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.682 2.255 . . . . 0.0 112.168 -179.56 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.092 0 CA-C-O 118.402 -1.221 . . . . 0.0 112.37 179.978 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 181' ' ' TYR . . . . . 0.444 ' O ' ' HG2' ' B' ' 182' ' ' ARG . 4.8 t80 . . . . . 0 N--CA 1.486 1.364 0 CA-C-O 120.746 0.308 . . . . 0.0 111.19 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 182' ' ' ARG . . . . . 0.444 ' HG2' ' O ' ' B' ' 181' ' ' TYR . 0.1 OUTLIER 60.74 152.32 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.03 179.988 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 183' ' ' GLY . . . . . . . . . . . . . . . -121.56 108.71 1.37 Allowed Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.579 -179.941 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 184' ' ' TRP . . . . . . . . . . . . . 3.6 p-90 -125.98 -37.87 2.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.771 0.319 . . . . 0.0 110.947 179.948 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 185' ' ' LYS . . . . . . . . . . . . . 8.4 tttt -138.71 132.28 30.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.717 179.806 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 186' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -153.55 37.16 0.46 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.943 -179.825 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 187' ' ' TRP . . . . . . . . . . . . . 88.2 m95 -80.27 159.79 25.74 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.012 0.434 . . . . 0.0 110.874 179.886 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -93.32 160.44 2.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.218 -179.743 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 189' ' ' TYR . . . . . 0.715 ' O ' ' HA ' ' A' ' 39' ' ' VAL . 0.1 OUTLIER -147.18 -101.56 0.09 Allowed 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.242 179.444 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 190' ' ' TYR . . . . . 0.462 ' H ' ' HB3' ' B' ' 189' ' ' TYR . 0.1 OUTLIER -79.69 149.21 31.29 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-O 120.94 0.4 . . . . 0.0 111.575 -179.91 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 191' ' ' THR . . . . . 0.509 ' OG1' ' HA ' ' A' ' 69' ' ' PRO . 0.2 OUTLIER -57.6 -162.94 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.287 -179.767 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 192' ' ' CYS . . . . . 0.724 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.2 OUTLIER -90.69 -60.81 1.82 Allowed 'General case' 0 CA--C 1.502 -0.871 0 CA-C-O 121.652 0.739 . . . . 0.0 112.431 -179.193 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 193' ' ' CYS . . . . . 0.724 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.0 OUTLIER -157.45 170.98 8.06 Favored Pre-proline 0 N--CA 1.438 -1.027 0 CA-C-N 114.055 -1.43 . . . . 0.0 111.737 -173.209 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 194' ' ' PRO . . . . . 0.489 ' HA ' ' HG2' ' A' ' 69' ' ' PRO . 1.5 Cg_endo -44.36 -70.85 0.06 OUTLIER 'Trans proline' 0 C--N 1.35 0.658 0 C-N-CA 123.149 2.566 . . . . 0.0 112.807 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 195' ' ' ASP . . . . . 0.55 ' CA ' ' HG3' ' A' ' 10' ' ' PRO . 0.6 OUTLIER -144.37 -85.73 0.13 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.004 -179.682 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 196' ' ' THR . . . . . 0.594 ' C ' ' H ' ' B' ' 198' ' ' TYR . 0.2 OUTLIER -157.06 43.53 0.18 Allowed Pre-proline 0 C--N 1.332 -0.185 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.817 -179.722 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 197' ' ' PRO . . . . . 0.491 ' CD ' ' N ' ' B' ' 196' ' ' THR . 72.7 Cg_endo -74.13 17.18 0.52 Allowed 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 121.627 1.551 . . . . 0.0 109.016 176.203 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 198' ' ' TYR . . . . . 0.594 ' H ' ' C ' ' B' ' 196' ' ' THR . 29.6 t80 . . . . . 0 C--O 1.249 1.064 0 CA-C-N 113.875 -1.512 . . . . 0.0 111.357 -178.781 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' ILE . . . . . 0.913 HG22 HD11 ' A' ' 22' ' ' LEU . 1.3 tp . . . . . 0 N--CA 1.487 1.407 0 CA-C-O 120.508 0.194 . . . . 0.0 111.079 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 0.686 HG12 HG13 ' A' ' 1' ' ' ILE . 9.9 p 177.08 147.0 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.517 -0.31 . . . . 0.0 110.847 179.902 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -154.9 131.1 10.31 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.77 0.319 . . . . 0.0 111.265 -179.847 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' HIS . . . . . 0.58 ' CA ' HG13 ' A' ' 14' ' ' VAL . 59.2 m-70 -48.69 171.75 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.944 179.712 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.748 ' CG2' ' HB3' ' A' ' 13' ' ' ALA . 0.8 OUTLIER -75.58 -167.46 0.68 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.661 -179.9 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.607 ' O ' ' HB3' ' A' ' 7' ' ' ALA . 9.6 t -46.07 -25.05 0.51 Allowed 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.364 179.819 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.607 ' HB3' ' O ' ' A' ' 6' ' ' THR . . . 83.36 78.89 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.534 179.71 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -87.4 -43.35 12.17 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.2 179.234 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.615 ' CB ' ' HD3' ' A' ' 10' ' ' PRO . 2.3 m -161.54 -78.54 0.01 OUTLIER Pre-proline 0 CA--C 1.535 0.375 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.905 179.308 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.615 ' HD3' ' CB ' ' A' ' 9' ' ' SER . 88.3 Cg_endo -80.11 -97.41 0.01 OUTLIER 'Trans proline' 0 C--N 1.353 0.808 0 C-N-CA 121.737 1.625 . . . . 0.0 112.312 179.646 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.609 HG23 ' O ' ' A' ' 10' ' ' PRO . 2.8 pt -161.72 162.67 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.335 -0.052 0 CA-C-O 120.655 0.264 . . . . 0.0 110.582 179.865 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.604 ' O ' HG23 ' A' ' 5' ' ' THR . 0.1 OUTLIER 176.35 148.54 0.11 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.013 0.435 . . . . 0.0 111.535 179.973 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.748 ' HB3' ' CG2' ' A' ' 5' ' ' THR . . . 43.9 42.51 4.62 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.803 -0.635 . . . . 0.0 112.01 179.373 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.608 ' C ' HG22 ' A' ' 15' ' ' THR . 2.0 t -65.18 101.81 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.491 179.638 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.631 ' HA ' HG23 ' A' ' 2' ' ' VAL . 0.0 OUTLIER 165.11 122.33 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.137 -179.393 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -114.75 83.11 8.77 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.009 -179.714 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.442 ' N ' ' CD ' ' A' ' 18' ' ' PRO . 28.4 Cg_exo -59.16 -47.94 15.75 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.332 2.021 . . . . 0.0 112.562 -179.988 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.442 ' CD ' ' N ' ' A' ' 17' ' ' PRO . 41.5 Cg_exo -56.74 175.1 0.32 Allowed 'Trans proline' 0 C--N 1.347 0.492 0 C-N-CA 122.394 2.063 . . . . 0.0 112.351 179.935 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 55.47 -166.69 3.2 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.872 -0.68 . . . . 0.0 112.819 179.756 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.785 ' N ' ' HB2' ' A' ' 46' ' ' ALA . 1.6 tt0 -159.8 22.93 0.18 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.636 0.255 . . . . 0.0 111.064 179.869 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.482 ' N ' ' O ' ' A' ' 45' ' ' ALA . 4.8 m120 -137.02 10.0 3.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.318 179.612 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.913 HD11 HG22 ' A' ' 1' ' ' ILE . 0.0 OUTLIER 70.11 -172.18 0.17 Allowed 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 112.846 0.684 . . . . 0.0 112.846 178.841 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.553 ' HA ' ' HA ' ' A' ' 44' ' ' CYS . 56.3 m -59.88 175.61 0.37 Allowed 'General case' 0 N--CA 1.46 0.048 0 CA-C-N 114.863 -1.062 . . . . 0.0 112.002 -179.738 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.603 ' CZ ' ' HB3' ' A' ' 45' ' ' ALA . 4.3 m-30 -119.17 -54.52 2.2 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.42 179.476 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.756 ' O ' HG13 ' A' ' 57' ' ' VAL . 0.0 OUTLIER 78.18 170.98 0.2 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.967 -179.041 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.494 ' CG ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER 177.95 74.93 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.447 -179.523 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 22.7 mtp -81.86 -176.37 6.07 Favored 'General case' 0 C--N 1.321 -0.644 0 C-N-CA 120.459 -0.496 . . . . 0.0 111.169 -179.416 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' TRP . . . . . 0.655 ' HB2' HG21 ' A' ' 39' ' ' VAL . 0.0 OUTLIER -133.38 86.93 2.34 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.503 179.885 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 29' ' ' CYS . . . . . 0.448 ' HA ' ' HG2' ' A' ' 36' ' ' ARG . 0.1 OUTLIER -148.34 66.29 1.08 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.587 -179.74 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.428 ' HB2' ' CZ3' ' A' ' 28' ' ' TRP . 1.2 t0 -52.08 90.51 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.845 -179.275 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . 38.9 -90.54 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.008 -0.542 . . . . 0.0 112.208 179.434 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.426 ' N ' ' O ' ' A' ' 30' ' ' ASP . 0.2 OUTLIER -64.07 79.7 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.983 0.42 . . . . 0.0 110.758 179.998 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 66.1 m -71.04 -73.44 0.17 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.909 -179.864 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.8 m 69.04 -64.8 0.31 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.918 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 45.7 m -137.55 53.89 1.84 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.974 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.448 ' HG2' ' HA ' ' A' ' 29' ' ' CYS . 2.1 tpt180 -100.29 -149.8 0.37 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.76 179.864 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -159.92 144.4 10.06 Favored Glycine 0 C--N 1.334 0.418 0 C-N-CA 120.294 -0.955 . . . . 0.0 112.844 -179.68 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.62 ' O ' HG23 ' B' ' 191' ' ' THR . 0.2 OUTLIER -73.2 102.65 3.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.135 0.493 . . . . 0.0 111.36 -179.759 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.707 HG13 ' O ' ' B' ' 189' ' ' TYR . 55.1 t -88.13 143.4 11.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.999 -179.928 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.626 ' CG1' HG22 ' B' ' 191' ' ' THR . 11.7 m -120.51 164.5 16.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.079 -179.639 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -175.79 -40.64 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.131 -179.842 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.489 HD11 ' ND2' ' A' ' 66' ' ' ASN . 0.5 OUTLIER 62.41 171.1 0.13 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.936 -179.845 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.414 ' HA3' ' HB2' ' A' ' 24' ' ' TYR . . . -159.52 -64.41 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.728 -0.748 . . . . 0.0 112.468 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.553 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 10.8 t 66.24 117.0 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.609 0.242 . . . . 0.0 110.814 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.603 ' HB3' ' CZ ' ' A' ' 24' ' ' TYR . . . -164.51 -170.32 2.0 Favored 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 120.618 -0.433 . . . . 0.0 111.83 -179.976 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.785 ' HB2' ' N ' ' A' ' 20' ' ' GLU . . . -132.17 34.55 3.78 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.215 -179.851 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.457 ' O ' HG22 ' A' ' 47' ' ' THR . 2.5 m -171.93 94.92 0.15 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.576 -179.691 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.48 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 1.8 t -147.24 46.06 0.47 Allowed Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.987 179.909 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.48 ' CD ' ' N ' ' A' ' 48' ' ' CYS . 87.0 Cg_endo -79.11 -5.38 14.43 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.396 2.064 . . . . 0.0 111.447 178.613 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 6.3 t -65.74 163.73 15.99 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.318 -179.703 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.559 ' O ' ' CB ' ' A' ' 52' ' ' LYS . 0.5 OUTLIER 172.36 175.35 0.09 Allowed 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.828 179.669 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.559 ' CB ' ' O ' ' A' ' 51' ' ' LYS . 4.8 mtpm? 115.79 -48.32 0.0 OUTLIER Pre-proline 0 N--CA 1.475 0.824 0 C-N-CA 124.171 0.989 . . . . 0.0 111.425 179.84 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' PRO . . . . . 0.504 ' HD3' ' HB2' ' A' ' 52' ' ' LYS . 24.9 Cg_exo -62.28 139.61 78.46 Favored 'Trans proline' 0 C--N 1.349 0.575 0 C-N-CA 122.131 1.887 . . . . 0.0 111.994 179.893 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -67.44 72.58 0.13 Allowed 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.865 -179.894 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -112.42 -174.46 2.46 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.89 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.593 ' O ' HG23 ' A' ' 58' ' ' THR . 11.1 tp10 -119.82 -21.22 7.29 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.512 -179.81 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.833 HG12 ' H ' ' A' ' 59' ' ' CYS . 60.9 t -48.01 -65.69 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.153 0 CA-C-O 121.385 0.612 . . . . 0.0 110.417 179.652 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.593 HG23 ' O ' ' A' ' 56' ' ' GLU . 4.1 p 59.65 8.71 1.35 Allowed 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.257 -0.883 . . . . 0.0 111.614 179.939 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' CYS . . . . . 0.833 ' H ' HG12 ' A' ' 57' ' ' VAL . 3.9 m 58.33 150.41 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.143 0 CA-C-O 121.011 0.434 . . . . 0.0 110.937 179.62 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.423 ' O ' ' O ' ' A' ' 21' ' ' ASN . 0.1 OUTLIER -122.26 138.18 54.59 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.08 -179.217 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.459 ' HA ' ' CB ' ' A' ' 22' ' ' LEU . 54.2 p -176.8 89.26 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.023 0.439 . . . . 0.0 111.062 179.572 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.451 HG22 ' C ' ' A' ' 61' ' ' SER . 0.6 OUTLIER 164.24 73.23 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.027 179.939 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ASP . . . . . 0.445 ' H ' HG21 ' A' ' 1' ' ' ILE . 0.6 OUTLIER 63.64 178.39 0.16 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.283 -179.38 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.487 ' CG ' ' O ' ' A' ' 64' ' ' LYS . 0.0 OUTLIER -52.75 90.57 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.406 0.622 . . . . 0.0 110.921 -179.912 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 65' ' ' CYS . . . . . 0.41 ' N ' ' O ' ' A' ' 63' ' ' ASP . 8.0 p -101.13 -11.48 19.55 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.63 -179.463 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.544 HD21 ' HB2' ' A' ' 7' ' ' ALA . 49.6 t30 -52.96 126.59 43.25 Favored Pre-proline 0 C--N 1.328 -0.36 0 C-N-CA 121.019 -0.272 . . . . 0.0 111.101 -179.229 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -74.04 119.39 5.82 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.526 2.151 . . . . 0.0 112.639 -179.872 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.539 ' HB3' ' HD2' ' A' ' 69' ' ' PRO . 1.7 m80 -69.83 178.51 1.0 Allowed Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.156 -0.474 . . . . 0.0 109.724 179.355 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.608 ' HA ' HG21 ' B' ' 191' ' ' THR . 69.8 Cg_exo -43.17 148.16 0.65 Allowed 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.438 2.092 . . . . 0.0 112.515 -179.979 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.546 ' CB ' ' HB2' ' A' ' 38' ' ' LYS . 0.0 OUTLIER -46.16 135.45 7.71 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.035 0.445 . . . . 0.0 111.257 -179.305 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -126.06 -75.04 0.59 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.551 -178.985 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -42.28 151.49 0.35 Allowed Pre-proline 0 N--CA 1.465 0.314 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.566 -179.424 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_exo -48.85 163.27 0.31 Allowed 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.663 2.242 . . . . 0.0 112.694 -179.794 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.327 -1.263 . . . . 0.0 112.351 179.99 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 181' ' ' TYR . . . . . . . . . . . . . 1.4 t80 . . . . . 0 N--CA 1.486 1.334 0 CA-C-O 120.912 0.387 . . . . 0.0 111.201 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 182' ' ' ARG . . . . . . . . . . . . . 24.7 mmt85 59.72 72.61 0.52 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.926 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 183' ' ' GLY . . . . . . . . . . . . . . . -137.33 -149.01 5.51 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.525 -179.959 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 184' ' ' TRP . . . . . . . . . . . . . 3.4 p90 -161.88 128.98 3.88 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.77 0.319 . . . . 0.0 110.796 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 185' ' ' LYS . . . . . . . . . . . . . 2.0 tppt? -111.54 -75.44 0.61 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.914 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 186' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -97.48 62.66 1.72 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.122 -179.879 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 187' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -59.94 -160.41 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.663 179.793 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 188' ' ' VAL . . . . . 0.67 HG22 ' H ' ' B' ' 190' ' ' TYR . 3.5 p -79.85 130.67 35.68 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.547 0 CA-C-O 120.779 0.323 . . . . 0.0 110.583 179.942 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 189' ' ' TYR . . . . . 0.707 ' O ' HG13 ' A' ' 39' ' ' VAL . 0.1 OUTLIER -95.39 31.45 1.97 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.617 -179.304 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 190' ' ' TYR . . . . . 0.67 ' H ' HG22 ' B' ' 188' ' ' VAL . 0.1 OUTLIER -86.79 153.8 21.4 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.664 -0.244 . . . . 0.0 110.818 179.865 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 191' ' ' THR . . . . . 0.626 HG22 ' CG1' ' A' ' 40' ' ' VAL . 43.2 p -42.53 161.38 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 116.616 -0.266 . . . . 0.0 111.039 179.704 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 192' ' ' CYS . . . . . 0.704 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.0 OUTLIER -90.24 -64.72 1.1 Allowed 'General case' 0 CA--C 1.501 -0.932 0 N-CA-C 112.774 0.657 . . . . 0.0 112.774 -179.047 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 193' ' ' CYS . . . . . 0.704 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.0 OUTLIER -162.63 155.61 16.8 Favored Pre-proline 0 N--CA 1.439 -1.006 0 CA-C-N 114.736 -1.12 . . . . 0.0 112.15 -172.986 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 194' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -98.02 137.58 0.4 Allowed 'Trans proline' 0 N--CA 1.455 -0.778 0 C-N-CA 123.384 2.723 . . . . 0.0 112.981 -179.646 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 67.97 129.77 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 121.114 0.483 . . . . 0.0 111.767 179.044 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 196' ' ' THR . . . . . 0.601 ' O ' HG22 ' B' ' 196' ' ' THR . 52.0 m -160.11 44.48 0.17 Allowed Pre-proline 0 C--N 1.331 -0.235 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.304 179.645 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 197' ' ' PRO . . . . . 0.508 ' CD ' ' N ' ' B' ' 196' ' ' THR . 80.9 Cg_endo -74.93 14.31 0.87 Allowed 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 121.745 1.63 . . . . 0.0 108.919 176.234 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 198' ' ' TYR . . . . . 0.568 ' H ' ' C ' ' B' ' 196' ' ' THR . 59.3 t80 . . . . . 0 C--O 1.248 1.022 0 CA-C-N 113.896 -1.502 . . . . 0.0 111.299 -178.84 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' ILE . . . . . 0.583 ' CG2' ' C ' ' A' ' 62' ' ' THR . 9.7 mm . . . . . 0 N--CA 1.487 1.406 0 CA-C-O 120.817 0.342 . . . . 0.0 111.156 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 0.671 HG12 ' HA ' ' A' ' 15' ' ' THR . 0.0 OUTLIER 45.01 -171.64 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 CA-C-N 116.155 -0.475 . . . . 0.0 112.231 179.461 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.442 ' O ' ' O ' ' A' ' 4' ' ' HIS . 1.0 OUTLIER -148.09 125.73 11.79 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 116.554 -0.294 . . . . 0.0 110.81 -178.827 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 4' ' ' HIS . . . . . 0.622 ' N ' HG12 ' A' ' 14' ' ' VAL . 7.5 m80 -37.83 162.95 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 112.073 0.397 . . . . 0.0 112.073 -179.809 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.926 HG23 ' CB ' ' A' ' 12' ' ' SER . 0.2 OUTLIER -137.85 163.36 31.62 Favored 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 112.452 0.538 . . . . 0.0 112.452 -178.354 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.571 ' O ' ' HB3' ' A' ' 7' ' ' ALA . 8.4 p 67.23 -43.34 0.45 Allowed 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 115.378 -0.828 . . . . 0.0 111.674 -179.749 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.571 ' HB3' ' O ' ' A' ' 6' ' ' THR . . . 77.07 -179.76 0.14 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.725 0.298 . . . . 0.0 110.782 -179.678 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.429 ' O ' HG22 ' A' ' 8' ' ' THR . 9.3 m 55.73 21.01 4.34 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.466 -0.333 . . . . 0.0 110.552 -179.453 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.45 ' OG ' HG22 ' A' ' 11' ' ' ILE . 7.0 t 167.52 143.92 0.06 OUTLIER Pre-proline 0 CA--C 1.53 0.196 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.604 -179.818 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.504 ' HA ' ' CD2' ' A' ' 4' ' ' HIS . 60.9 Cg_endo -82.51 -20.16 5.95 Favored 'Trans proline' 0 C--N 1.344 0.308 0 C-N-CA 123.049 2.499 . . . . 0.0 112.04 179.719 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.45 HG22 ' OG ' ' A' ' 9' ' ' SER . 14.4 tt -37.8 -26.92 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 N-CA-C 113.699 1.0 . . . . 0.0 113.699 -179.255 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.926 ' CB ' HG23 ' A' ' 5' ' ' THR . 0.8 OUTLIER -80.61 5.46 15.42 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.68 0.276 . . . . 0.0 111.7 -179.275 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.599 ' O ' HG13 ' A' ' 14' ' ' VAL . . . 56.81 -116.78 1.0 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.585 -179.967 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.622 HG12 ' N ' ' A' ' 4' ' ' HIS . 4.4 m -159.82 125.02 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.428 0 CA-C-O 120.754 0.312 . . . . 0.0 110.93 -179.503 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.671 ' HA ' HG12 ' A' ' 2' ' ' VAL . 0.5 OUTLIER 176.78 142.95 0.08 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.96 179.952 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 5.0 t -158.98 74.29 3.46 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.958 -179.926 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.474 ' N ' ' CD ' ' A' ' 18' ' ' PRO . 31.2 Cg_exo -58.37 -45.52 30.2 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 122.612 2.208 . . . . 0.0 112.743 -179.838 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.474 ' CD ' ' N ' ' A' ' 17' ' ' PRO . 81.0 Cg_exo -47.56 -63.75 0.3 Allowed 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 122.535 2.157 . . . . 0.0 112.527 -179.891 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -99.43 146.84 18.14 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.186 179.805 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -138.41 29.43 2.43 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.614 0.245 . . . . 0.0 111.199 -179.742 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -141.02 85.39 1.98 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.222 -179.934 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.703 HD12 ' N ' ' A' ' 48' ' ' CYS . 1.4 mt 62.62 123.5 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.574 -0.284 . . . . 0.0 111.537 178.952 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.599 ' HA ' ' HA ' ' A' ' 44' ' ' CYS . 3.8 m -71.8 157.84 37.17 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-O 120.973 0.416 . . . . 0.0 110.788 179.861 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.666 ' HA ' ' HB2' ' A' ' 45' ' ' ALA . 0.8 OUTLIER -65.31 65.3 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.778 -0.646 . . . . 0.0 112.012 -178.97 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.401 ' N ' ' O ' ' A' ' 23' ' ' CYS . 1.1 ttt85 -57.58 82.16 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.906 0.384 . . . . 0.0 110.45 179.215 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.501 ' HA ' ' O ' ' A' ' 56' ' ' GLU . 32.8 tttt -85.18 156.59 20.94 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.383 -179.231 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -177.34 100.84 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.764 179.708 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 34.4 t-105 -56.86 -75.27 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.776 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 1.1 m 49.83 81.09 0.06 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.4 179.257 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -62.5 99.38 0.14 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.713 179.737 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . 63.76 -79.55 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.974 -179.75 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -97.32 138.56 34.59 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.601 179.664 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 22.7 m -84.93 -79.08 0.23 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.069 -179.788 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 38.7 t 64.99 -74.76 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.936 -179.904 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.413 ' HA ' ' HE2' ' A' ' 70' ' ' LYS . 1.0 OUTLIER 179.65 29.68 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.09 179.809 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -119.28 -3.16 10.55 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.528 -179.803 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -124.17 54.76 0.72 Allowed Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.57 -0.824 . . . . 0.0 113.307 -179.23 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.469 ' HG2' ' HG3' ' A' ' 70' ' ' LYS . 0.1 OUTLIER -92.05 26.16 2.58 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.719 0.26 . . . . 0.0 111.192 179.625 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.518 ' O ' HG22 ' A' ' 40' ' ' VAL . 47.8 t -48.93 -61.07 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 CA-C-O 120.881 0.372 . . . . 0.0 110.933 179.788 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.518 HG22 ' O ' ' A' ' 39' ' ' VAL . 18.7 m 45.48 -174.92 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.759 -0.655 . . . . 0.0 112.164 179.483 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.451 ' O ' HD12 ' A' ' 42' ' ' LEU . 5.8 tp10 -177.08 -70.85 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.596 -179.953 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.744 HD22 ' HB3' ' A' ' 65' ' ' CYS . 0.6 OUTLIER 66.18 137.48 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.335 179.378 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.481 ' O ' ' HB2' ' A' ' 44' ' ' CYS . . . 161.91 50.1 0.02 OUTLIER Glycine 0 CA--C 1.521 0.459 0 C-N-CA 120.41 -0.9 . . . . 0.0 113.542 -179.993 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.599 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 1.7 m 70.77 118.28 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 112.635 0.606 . . . . 0.0 112.635 179.034 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.666 ' HB2' ' HA ' ' A' ' 24' ' ' TYR . . . -122.48 174.29 7.14 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.537 179.614 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.891 ' O ' HG22 ' A' ' 47' ' ' THR . . . -101.76 78.71 1.85 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.479 179.77 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.891 HG22 ' O ' ' A' ' 46' ' ' ALA . 3.5 t 61.79 173.26 0.12 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.637 -0.71 . . . . 0.0 111.507 -179.727 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.703 ' N ' HD12 ' A' ' 22' ' ' LEU . 6.0 m -69.74 -50.77 17.06 Favored Pre-proline 0 C--N 1.331 -0.224 0 CA-C-N 116.089 -0.505 . . . . 0.0 112.287 -179.031 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.609 ' HD2' HG23 ' A' ' 47' ' ' THR . 42.3 Cg_exo -34.1 80.82 0.0 OUTLIER 'Trans proline' 0 C--N 1.353 0.787 0 C-N-CA 122.663 2.242 . . . . 0.0 111.622 179.838 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.676 ' N ' ' O ' ' A' ' 48' ' ' CYS . 3.6 t -161.26 -34.77 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.12 -0.945 . . . . 0.0 111.208 -177.571 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.626 ' CG ' HG22 ' A' ' 58' ' ' THR . 0.1 OUTLIER -43.08 -55.85 3.66 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.83 -179.492 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.454 ' CB ' ' CD ' ' A' ' 53' ' ' PRO . 0.0 OUTLIER -45.99 -65.68 0.63 Allowed Pre-proline 0 C--N 1.331 -0.21 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.074 -179.75 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 53' ' ' PRO . . . . . 0.454 ' CD ' ' CB ' ' A' ' 52' ' ' LYS . 32.7 Cg_endo -64.58 -154.12 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.088 1.858 . . . . 0.0 110.965 178.916 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -45.0 93.7 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.694 0 CA-C-O 120.954 0.406 . . . . 0.0 110.843 179.671 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.497 ' O ' ' CG ' ' A' ' 56' ' ' GLU . 0.0 OUTLIER -61.33 -155.55 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.453 -179.062 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.501 ' O ' ' HA ' ' A' ' 26' ' ' LYS . 2.5 pt-20 58.34 41.28 23.4 Favored 'General case' 0 CA--C 1.527 0.091 0 CA-C-O 121.369 0.604 . . . . 0.0 110.546 -178.898 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 47.6 t -159.61 -50.49 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.092 -0.958 . . . . 0.0 109.674 179.418 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.626 HG22 ' CG ' ' A' ' 51' ' ' LYS . 53.0 p 32.88 -91.41 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 115.002 -0.999 . . . . 0.0 112.711 179.38 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' CYS . . . . . 0.457 ' HB2' ' HB3' ' A' ' 22' ' ' LEU . 0.8 OUTLIER -179.78 155.94 0.66 Allowed 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.4 -179.373 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.544 ' SG ' HD23 ' A' ' 42' ' ' LEU . 0.0 OUTLIER -130.71 4.3 4.57 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 112.06 0.392 . . . . 0.0 112.06 -179.434 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.546 ' CA ' ' HA ' ' A' ' 22' ' ' LEU . 82.4 p 44.63 -162.26 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.241 0 N-CA-C 110.22 -0.289 . . . . 0.0 110.22 -179.17 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.583 ' C ' ' CG2' ' A' ' 1' ' ' ILE . 71.4 p -99.03 123.05 43.06 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 179.291 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 5.1 p30 167.67 179.19 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.908 0.385 . . . . 0.0 111.046 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.67 58.67 3.35 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.395 179.52 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' CYS . . . . . 0.744 ' HB3' HD22 ' A' ' 42' ' ' LEU . 0.6 OUTLIER -59.49 -70.88 0.14 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.613 179.983 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.617 ' C ' HD13 ' A' ' 42' ' ' LEU . 1.3 p-10 49.69 161.64 0.04 OUTLIER Pre-proline 0 N--CA 1.463 0.22 0 CA-C-N 115.576 -0.738 . . . . 0.0 112.413 179.761 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' PRO . . . . . 0.538 ' CB ' HG21 ' B' ' 191' ' ' THR . 16.9 Cg_exo -68.64 62.16 1.2 Allowed 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 123.193 2.596 . . . . 0.0 112.6 -179.6 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 56.7 p-80 -59.22 109.39 1.87 Allowed Pre-proline 0 C--N 1.328 -0.369 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.702 179.76 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.442 ' HG3' ' HA ' ' B' ' 192' ' ' CYS . 52.4 Cg_exo -53.3 124.72 16.36 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.305 2.003 . . . . 0.0 111.989 -179.917 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.469 ' HG3' ' HG2' ' A' ' 38' ' ' LYS . 0.0 OUTLIER -90.79 -2.99 57.75 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.728 -179.487 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.419 ' HB2' ' CE ' ' A' ' 38' ' ' LYS . 31.7 tt0 -61.32 -17.98 56.36 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.612 -0.267 . . . . 0.0 111.379 -179.887 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.429 ' H ' ' HG3' ' A' ' 72' ' ' ARG . 0.0 OUTLIER -100.14 102.65 18.75 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-O 120.621 0.248 . . . . 0.0 111.079 -179.86 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_endo -79.93 172.86 13.48 Favored 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.615 2.21 . . . . 0.0 112.295 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.084 0 CA-C-O 118.323 -1.265 . . . . 0.0 112.586 -179.938 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 181' ' ' TYR . . . . . . . . . . . . . 15.8 t80 . . . . . 0 N--CA 1.485 1.304 0 CA-C-O 120.879 0.371 . . . . 0.0 111.058 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 182' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -144.88 -168.81 3.02 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.896 179.844 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 183' ' ' GLY . . . . . . . . . . . . . . . -155.67 -44.4 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.511 -179.892 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 184' ' ' TRP . . . . . 0.45 ' O ' ' CB ' ' B' ' 185' ' ' LYS . 48.2 p-90 -74.84 -178.76 3.85 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.651 0.262 . . . . 0.0 110.931 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 185' ' ' LYS . . . . . 0.45 ' CB ' ' O ' ' B' ' 184' ' ' TRP . 0.2 OUTLIER 86.99 -40.84 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.247 179.919 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 186' ' ' HIS . . . . . 0.412 ' N ' ' HG2' ' B' ' 185' ' ' LYS . 44.2 t-80 -80.23 -30.4 38.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.788 0.328 . . . . 0.0 110.986 -179.983 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 187' ' ' TRP . . . . . . . . . . . . . 48.8 m0 -58.54 178.69 0.1 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.105 -179.861 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -79.76 158.33 4.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.055 -179.757 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 189' ' ' TYR . . . . . 0.427 ' O ' ' HA ' ' A' ' 39' ' ' VAL . 0.6 OUTLIER -156.24 -26.44 0.1 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.682 -179.798 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 190' ' ' TYR . . . . . 0.444 ' HA ' ' O ' ' A' ' 38' ' ' LYS . 0.1 OUTLIER -160.12 125.84 4.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.731 0.301 . . . . 0.0 111.274 -179.538 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 191' ' ' THR . . . . . 0.538 HG21 ' CB ' ' A' ' 67' ' ' PRO . 2.0 m -90.02 76.73 6.97 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.319 179.39 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 192' ' ' CYS . . . . . 0.717 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.0 OUTLIER -90.57 174.13 7.69 Favored 'General case' 0 CA--C 1.499 -0.999 0 CA-C-O 122.162 0.982 . . . . 0.0 111.87 -179.152 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 193' ' ' CYS . . . . . 0.717 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.1 OUTLIER 43.93 81.41 0.25 Allowed Pre-proline 0 N--CA 1.441 -0.896 0 CA-C-N 113.114 -1.857 . . . . 0.0 112.6 173.507 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 194' ' ' PRO . . . . . 0.406 ' O ' ' CD ' ' A' ' 10' ' ' PRO . 96.2 Cg_endo -83.36 -43.27 0.08 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.552 0 C-N-CA 122.69 2.26 . . . . 0.0 112.213 179.591 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -43.48 98.88 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.498 -179.948 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 196' ' ' THR . . . . . 0.7 ' N ' ' HD3' ' B' ' 197' ' ' PRO . 2.9 p -149.83 45.42 0.36 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.821 179.868 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 197' ' ' PRO . . . . . 0.7 ' HD3' ' N ' ' B' ' 196' ' ' THR . 2.5 Cg_endo -77.17 11.61 2.02 Favored 'Trans proline' 0 N--CA 1.455 -0.773 0 C-N-CA 121.851 1.701 . . . . 0.0 108.537 175.981 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 198' ' ' TYR . . . . . 0.534 ' H ' ' C ' ' B' ' 196' ' ' THR . 10.9 t80 . . . . . 0 C--O 1.249 1.063 0 CA-C-N 113.746 -1.57 . . . . 0.0 111.27 -178.796 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 19.2 mm . . . . . 0 N--CA 1.485 1.278 0 CA-C-O 120.846 0.355 . . . . 0.0 111.132 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 27.7 m -136.19 169.78 19.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.99 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 3.2 t -160.31 100.65 1.36 Allowed 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 -179.536 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' HIS . . . . . 0.412 ' CE1' ' HA ' ' A' ' 64' ' ' LYS . 3.7 m170 -36.01 120.36 0.62 Allowed 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.48 179.392 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -84.44 99.86 10.95 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.978 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.445 ' CG2' ' N ' ' A' ' 7' ' ' ALA . 0.4 OUTLIER 81.17 -53.97 0.3 Allowed 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.213 179.784 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.445 ' N ' ' CG2' ' A' ' 6' ' ' THR . . . 58.98 -96.14 0.06 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.681 -0.236 . . . . 0.0 110.884 -179.688 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 5.3 p . . . . . 0 CA--C 1.529 0.156 0 CA-C-O 120.673 0.273 . . . . 0.0 111.396 179.666 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.467 ' N ' ' HD2' ' A' ' 18' ' ' PRO . 46.2 Cg_exo . . . . . 0 CA--C 1.528 0.213 0 N-CA-C 112.691 0.227 . . . . 0.0 112.691 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.467 ' HD2' ' N ' ' A' ' 17' ' ' PRO . 71.8 Cg_endo -78.45 164.77 25.99 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.281 1.987 . . . . 0.0 112.36 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 48.37 87.12 0.01 OUTLIER Glycine 0 C--N 1.33 0.237 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.437 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -87.37 82.14 7.65 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.828 0.347 . . . . 0.0 111.263 -179.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -168.38 -74.49 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.968 179.73 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.958 HD23 ' CB ' ' A' ' 61' ' ' SER . 1.0 OUTLIER -125.45 154.42 42.03 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.018 -179.626 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.602 ' C ' ' H ' ' A' ' 44' ' ' CYS . 2.4 p -109.34 29.15 7.82 Favored 'General case' 0 CA--C 1.534 0.354 0 N-CA-C 112.228 0.455 . . . . 0.0 112.228 -179.172 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.64 ' O ' ' HB2' ' A' ' 60' ' ' CYS . 1.9 m-85 34.82 -159.25 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 122.774 0.43 . . . . 0.0 111.654 179.385 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.572 ' CB ' ' O ' ' A' ' 24' ' ' TYR . 1.2 mtp180 97.23 117.17 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 122.591 0.356 . . . . 0.0 111.513 179.749 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -147.98 -93.82 0.08 Allowed 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.236 178.725 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 1.9 mtm 172.15 -164.12 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.255 0 C-N-CA 121.108 -0.237 . . . . 0.0 110.773 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 18.1 t-105 -133.18 -84.53 0.46 Allowed 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 116.592 -0.276 . . . . 0.0 111.062 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER 54.53 175.14 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 120.813 0.339 . . . . 0.0 110.726 -179.63 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -86.21 -76.23 0.35 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.983 0.421 . . . . 0.0 110.277 179.456 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -118.1 -130.67 0.3 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.854 179.251 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.468 ' O ' ' N ' ' A' ' 34' ' ' SER . 26.7 p90 -68.47 -35.89 78.19 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 179.121 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER 34.62 -86.19 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 115.345 -0.843 . . . . 0.0 112.771 179.485 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.468 ' N ' ' O ' ' A' ' 32' ' ' PHE . 0.3 OUTLIER 78.32 28.54 0.48 Allowed 'General case' 0 N--CA 1.462 0.173 0 CA-C-O 120.967 0.413 . . . . 0.0 110.338 -179.175 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 1.6 p -152.95 -66.41 0.16 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.621 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -86.45 -155.36 0.25 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.718 179.821 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 88.91 20.19 47.88 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.711 -0.756 . . . . 0.0 112.49 -179.574 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.454 ' HA ' ' HG3' ' A' ' 70' ' ' LYS . 0.1 OUTLIER . . . . . 0 N--CA 1.464 0.233 0 CA-C-O 121.227 0.537 . . . . 0.0 111.629 -179.726 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . 0.459 ' N ' ' HG2' ' A' ' 25' ' ' ARG . . . . . . . . 0 N--CA 1.451 -0.318 0 CA-C-O 120.817 0.12 . . . . 0.0 113.336 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.602 ' H ' ' C ' ' A' ' 23' ' ' CYS . 0.1 OUTLIER 62.79 144.66 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.17 0.509 . . . . 0.0 112.286 178.819 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.577 ' HB3' ' CE1' ' A' ' 24' ' ' TYR . . . -147.06 -68.78 0.25 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.747 179.33 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.573 ' HB2' ' O ' ' A' ' 45' ' ' ALA . . . 166.14 -37.01 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.666 179.863 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.63 ' HA ' HD12 ' A' ' 22' ' ' LEU . 10.4 t -178.78 173.21 1.27 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.637 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.531 ' N ' ' HD3' ' A' ' 49' ' ' PRO . 22.3 p -142.76 52.81 2.42 Favored Pre-proline 0 C--N 1.331 -0.196 0 N-CA-C 111.995 0.369 . . . . 0.0 111.995 -179.778 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.6 ' HD3' HG23 ' A' ' 47' ' ' THR . 32.3 Cg_exo -57.52 -21.64 47.11 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 121.849 1.699 . . . . 0.0 110.82 178.526 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 3.5 t -61.46 -166.91 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.248 -0.887 . . . . 0.0 111.108 179.689 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 2.0 ptmm? 177.86 39.91 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.706 179.779 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.45 ' HD2' ' O ' ' A' ' 52' ' ' LYS . 0.0 OUTLIER -76.92 154.99 83.05 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.141 -179.924 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -71.19 -89.58 0.0 OUTLIER 'Trans proline' 0 CA--C 1.531 0.365 0 C-N-CA 122.457 2.105 . . . . 0.0 112.184 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.469 0.509 0 CA-C-O 120.597 0.237 . . . . 0.0 110.603 179.779 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.443 ' O ' ' HB3' ' A' ' 48' ' ' CYS . 0.2 OUTLIER . . . . . 0 N--CA 1.456 -0.159 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . 0.825 ' CB ' HD13 ' A' ' 22' ' ' LEU . 1.3 p 178.73 146.88 0.17 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.552 179.425 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.64 ' HB2' ' O ' ' A' ' 24' ' ' TYR . 11.9 m -133.96 84.68 2.14 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.462 -179.256 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.958 ' CB ' HD23 ' A' ' 22' ' ' LEU . 2.1 t -93.58 74.75 4.4 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.91 0.386 . . . . 0.0 110.832 179.879 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.417 HG22 ' H ' ' A' ' 63' ' ' ASP . 0.2 OUTLIER -157.95 -164.28 1.49 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.7 -179.999 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . 0.417 ' H ' HG22 ' A' ' 62' ' ' THR . 10.8 p-10 -124.61 28.25 6.63 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.197 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.412 ' HA ' ' CE1' ' A' ' 4' ' ' HIS . 0.6 OUTLIER 179.54 43.81 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.05 0.452 . . . . 0.0 110.776 179.776 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 13.5 t -77.79 -27.23 50.15 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.084 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -58.52 105.32 0.52 Allowed Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.456 -179.65 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 7.1 Cg_exo -73.51 -156.16 0.05 OUTLIER 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.757 2.305 . . . . 0.0 111.908 179.576 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.423 ' CB ' ' HD2' ' A' ' 69' ' ' PRO . 0.7 OUTLIER -106.77 166.59 10.85 Favored Pre-proline 0 C--N 1.331 -0.211 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.818 179.831 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . 0.423 ' HD2' ' CB ' ' A' ' 68' ' ' HIS . 9.9 Cg_endo -53.47 177.33 0.07 OUTLIER 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.619 2.212 . . . . 0.0 112.528 -179.845 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.454 ' HG3' ' HA ' ' A' ' 38' ' ' LYS . 3.0 mmpt? -85.11 -56.48 3.53 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.351 -179.623 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 31.7 mt-30 . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.446 -179.682 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 192' ' ' CYS . . . . . 0.702 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.0 OUTLIER . . . . . 0 CA--C 1.499 -0.988 0 CA-C-O 122.06 0.933 . . . . 0.0 112.101 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 193' ' ' CYS . . . . . 0.702 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.1 OUTLIER 41.09 68.6 2.37 Favored Pre-proline 0 C--N 1.314 -0.948 0 CA-C-N 113.149 -1.842 . . . . 0.0 112.209 173.817 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 194' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -73.1 -70.72 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.845 2.363 . . . . 0.0 112.422 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 166.56 -20.69 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.465 -179.907 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 196' ' ' THR . . . . . 0.756 ' C ' ' H ' ' B' ' 198' ' ' TYR . 0.6 OUTLIER -79.36 -20.84 0.33 Allowed Pre-proline 0 C--N 1.331 -0.198 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -179.744 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 197' ' ' PRO . . . . . 0.685 ' CD ' ' N ' ' B' ' 196' ' ' THR . 17.8 Cg_exo -64.26 25.13 0.07 OUTLIER 'Trans proline' 0 C--N 1.353 0.815 0 C-N-CA 121.218 1.279 . . . . 0.0 109.575 176.733 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 198' ' ' TYR . . . . . 0.756 ' H ' ' C ' ' B' ' 196' ' ' THR . 5.6 t80 . . . . . 0 C--O 1.248 1.022 0 CA-C-N 114.372 -1.285 . . . . 0.0 111.346 -178.74 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 1' ' ' ILE . . . . . 0.654 ' N ' HD13 ' A' ' 1' ' ' ILE . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.375 0 CA-C-O 120.989 0.423 . . . . 0.0 111.131 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 9.9 m -132.38 -179.56 3.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.351 179.496 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 7.9 t -135.16 118.09 16.29 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.594 -0.442 . . . . 0.0 112.114 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' HIS . . . . . 0.455 ' CD2' ' CB ' ' A' ' 64' ' ' LYS . 1.3 m-70 -35.07 143.55 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.343 179.356 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.445 HG22 ' H ' ' A' ' 6' ' ' THR . 0.2 OUTLIER -57.34 -164.23 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.47 -179.306 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.445 ' H ' HG22 ' A' ' 5' ' ' THR . 13.9 t -90.6 42.64 1.11 Allowed 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 112.295 0.479 . . . . 0.0 112.295 -178.778 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.62 ' HB1' ' HG2' ' B' ' 194' ' ' PRO . . . -150.52 -178.6 6.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.53 0.205 . . . . 0.0 111.003 179.312 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.561 HG21 ' HG3' ' B' ' 197' ' ' PRO . 0.5 OUTLIER . . . . . 0 CA--C 1.539 0.529 0 CA-C-N 116.687 -0.233 . . . . 0.0 110.966 -179.521 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.628 ' N ' ' HD2' ' A' ' 18' ' ' PRO . 77.9 Cg_exo . . . . . 0 CA--C 1.532 0.391 0 N-CA-C 113.461 0.523 . . . . 0.0 113.461 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.628 ' HD2' ' N ' ' A' ' 17' ' ' PRO . 5.7 Cg_endo -48.97 -177.49 0.01 OUTLIER 'Trans proline' 0 C--N 1.351 0.685 0 C-N-CA 122.527 2.152 . . . . 0.0 112.766 -179.209 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.406 ' O ' ' CB ' ' A' ' 20' ' ' GLU . . . -42.25 91.03 0.01 OUTLIER Glycine 0 C--N 1.334 0.452 0 CA-C-N 116.0 -0.546 . . . . 0.0 113.164 -179.606 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.439 ' N ' ' O ' ' A' ' 18' ' ' PRO . 1.6 mt-10 162.95 -173.46 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 122.595 0.358 . . . . 0.0 110.2 -179.87 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 8.1 m-20 -178.94 -79.47 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.806 0.336 . . . . 0.0 111.194 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.703 HD21 ' N ' ' A' ' 60' ' ' CYS . 3.5 tm? -59.05 91.72 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.316 -179.725 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.547 ' HA ' ' HA ' ' A' ' 44' ' ' CYS . 4.6 t -66.02 63.06 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 120.738 0.304 . . . . 0.0 111.272 179.828 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.526 ' N ' HD13 ' A' ' 22' ' ' LEU . 6.7 p90 -47.88 145.27 3.0 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.019 0.438 . . . . 0.0 111.933 -179.62 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.26 137.76 37.8 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.485 179.744 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -78.25 150.48 33.4 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.955 -179.886 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . 0.432 ' O ' ' N ' ' A' ' 29' ' ' CYS . 14.7 ptm -143.54 79.29 1.63 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.976 179.885 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' TRP . . . . . 0.412 ' O ' ' HA2' ' A' ' 37' ' ' GLY . 69.2 t-105 -58.63 79.77 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.341 -179.831 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . 0.432 ' N ' ' O ' ' A' ' 27' ' ' MET . 0.5 OUTLIER -170.02 119.02 0.6 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.074 179.762 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.79 -162.01 0.59 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.77 179.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -56.37 -38.13 71.01 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.328 -179.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 27.3 m-85 -102.96 -79.17 0.53 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.921 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.477 ' O ' ' N ' ' A' ' 35' ' ' SER . 19.5 p 38.22 30.77 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 112.208 0.447 . . . . 0.0 112.208 179.773 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.3 m 48.46 -86.9 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 116.594 -0.276 . . . . 0.0 111.392 -179.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.477 ' N ' ' O ' ' A' ' 33' ' ' CYS . 97.6 p -176.49 71.23 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.787 0.327 . . . . 0.0 110.841 179.803 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 20.8 mtt180 -115.05 -87.93 0.58 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.1 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.412 ' HA2' ' O ' ' A' ' 28' ' ' TRP . . . 51.6 23.32 9.63 Favored Glycine 0 C--N 1.334 0.431 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.996 179.883 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.565 ' CB ' ' HG3' ' A' ' 70' ' ' LYS . 0.0 OUTLIER . . . . . 0 CA--C 1.532 0.28 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 -179.422 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . 0.495 ' HA3' ' CE1' ' A' ' 24' ' ' TYR . . . . . . . . 0 N--CA 1.45 -0.385 0 N-CA-C 113.522 0.169 . . . . 0.0 113.522 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.547 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 0.0 OUTLIER 70.41 99.53 0.06 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.239 0.543 . . . . 0.0 111.277 -179.263 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -128.4 -139.49 0.24 Allowed 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 115.342 -0.845 . . . . 0.0 110.09 179.747 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -167.98 36.53 0.03 OUTLIER 'General case' 0 C--N 1.334 -0.1 0 O-C-N 122.253 -0.28 . . . . 0.0 111.658 179.772 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 6.8 t -176.81 40.89 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 120.99 -0.284 . . . . 0.0 111.718 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 63.5 m 39.24 73.23 0.83 Allowed Pre-proline 0 N--CA 1.466 0.355 0 CA-C-N 116.731 -0.213 . . . . 0.0 111.538 179.712 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.44 ' HG2' ' HB2' ' A' ' 24' ' ' TYR . 10.6 Cg_endo -53.14 -19.08 11.32 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.128 1.886 . . . . 0.0 110.847 178.601 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.439 ' HB2' ' HA ' ' A' ' 58' ' ' THR . 39.5 t -38.24 -74.19 0.04 OUTLIER 'General case' 0 N--CA 1.457 -0.088 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.983 179.347 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 23.3 mmtt 67.89 -161.87 0.21 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.581 -179.705 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.599 ' CB ' ' CD ' ' A' ' 53' ' ' PRO . 9.5 mmmt -96.6 -163.72 0.05 OUTLIER Pre-proline 0 CA--C 1.539 0.533 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.617 -179.522 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . 0.599 ' CD ' ' CB ' ' A' ' 52' ' ' LYS . 35.5 Cg_exo -39.98 -28.3 0.25 Allowed 'Trans proline' 0 C--N 1.356 0.945 0 C-N-CA 122.644 2.229 . . . . 0.0 114.484 -178.587 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . 0.456 ' CZ ' ' HB2' ' A' ' 52' ' ' LYS . 0.1 OUTLIER . . . . . 0 N--CA 1.474 0.767 0 C-N-CA 120.556 -0.458 . . . . 0.0 111.422 -179.723 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.439 ' HA ' ' HB2' ' A' ' 50' ' ' SER . 0.0 OUTLIER . . . . . 0 CA--C 1.529 0.145 0 N-CA-C 110.412 -0.218 . . . . 0.0 110.412 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . 0.457 ' HA ' HD11 ' A' ' 22' ' ' LEU . 1.6 t -50.63 105.79 0.11 Allowed 'General case' 0 C--O 1.232 0.183 0 CA-C-O 121.025 0.44 . . . . 0.0 110.239 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.703 ' N ' HD21 ' A' ' 22' ' ' LEU . 0.5 OUTLIER -78.31 -97.04 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 115.902 -0.59 . . . . 0.0 112.315 -178.522 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.502 ' N ' HD22 ' A' ' 22' ' ' LEU . 13.1 t 39.1 88.18 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 111.608 0.225 . . . . 0.0 111.608 -179.516 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.513 HG23 ' H ' ' A' ' 63' ' ' ASP . 0.7 OUTLIER 175.75 -59.49 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 111.791 0.293 . . . . 0.0 111.791 179.983 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . 0.513 ' H ' HG23 ' A' ' 62' ' ' THR . 8.6 m-20 -130.76 -158.8 0.92 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.784 0.326 . . . . 0.0 111.381 -179.251 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.455 ' CB ' ' CD2' ' A' ' 4' ' ' HIS . 0.7 OUTLIER -77.49 -2.43 35.44 Favored 'General case' 0 N--CA 1.461 0.124 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.975 -179.467 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 56.1 m 36.02 42.26 0.16 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.952 -0.567 . . . . 0.0 112.354 179.39 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.405 ' N ' ' HD3' ' A' ' 67' ' ' PRO . 2.3 m-80 -133.4 53.03 9.5 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 120.695 0.283 . . . . 0.0 111.491 179.965 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . 0.405 ' HD3' ' N ' ' A' ' 66' ' ' ASN . 96.1 Cg_endo -79.81 -167.55 0.52 Allowed 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.534 2.156 . . . . 0.0 112.184 179.532 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 41.8 m80 -68.97 112.1 10.49 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.671 179.802 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_exo -60.9 -67.14 0.05 OUTLIER 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.476 2.117 . . . . 0.0 112.517 -179.536 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.565 ' HG3' ' CB ' ' A' ' 38' ' ' LYS . 1.0 OUTLIER -73.76 145.97 44.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.011 0.434 . . . . 0.0 111.087 -179.71 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.328 -0.36 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.212 -179.715 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 192' ' ' CYS . . . . . 0.685 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.0 OUTLIER . . . . . 0 CA--C 1.498 -1.034 0 CA-C-O 122.132 0.968 . . . . 0.0 111.399 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 193' ' ' CYS . . . . . 0.686 ' N ' ' HD3' ' B' ' 194' ' ' PRO . 0.1 OUTLIER 38.61 48.09 1.5 Allowed Pre-proline 0 C--N 1.314 -0.942 0 CA-C-N 112.995 -1.911 . . . . 0.0 112.843 174.12 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 194' ' ' PRO . . . . . 0.686 ' HD3' ' N ' ' B' ' 193' ' ' CYS . 57.3 Cg_endo -100.67 -69.6 0.0 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.966 0 C-N-CA 123.602 2.868 . . . . 0.0 112.838 -179.452 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -70.46 -84.75 0.03 OUTLIER 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.153 -0.476 . . . . 0.0 112.012 -179.131 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 196' ' ' THR . . . . . 0.629 ' C ' ' H ' ' B' ' 198' ' ' TYR . 10.2 t -160.17 52.04 0.43 Allowed Pre-proline 0 C--N 1.332 -0.16 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 -179.089 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 197' ' ' PRO . . . . . 0.6 ' HD3' ' N ' ' B' ' 196' ' ' THR . 2.6 Cg_exo -73.08 15.89 0.46 Allowed 'Trans proline' 0 N--CA 1.459 -0.514 0 C-N-CA 121.879 1.72 . . . . 0.0 108.73 175.848 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 198' ' ' TYR . . . . . 0.629 ' H ' ' C ' ' B' ' 196' ' ' THR . 51.4 t80 . . . . . 0 C--O 1.25 1.079 0 CA-C-N 113.939 -1.482 . . . . 0.0 111.176 -178.6 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 24.5 mm . . . . . 0 N--CA 1.486 1.355 0 CA-C-O 120.789 0.328 . . . . 0.0 111.068 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . 0.591 HG22 ' H ' ' A' ' 3' ' ' CYS . 0.5 OUTLIER -155.0 -176.18 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.901 179.872 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.591 ' H ' HG22 ' A' ' 2' ' ' VAL . 21.6 m -103.45 -174.63 2.59 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.147 0.499 . . . . 0.0 111.561 -179.537 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' HIS . . . . . 0.5 ' O ' ' CD2' ' A' ' 4' ' ' HIS . 4.3 t60 -139.53 97.59 3.31 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.925 179.307 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.1 m 28.63 36.78 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 114.673 -1.149 . . . . 0.0 112.71 -179.736 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.546 ' O ' HG22 ' A' ' 6' ' ' THR . 21.0 m 48.94 21.67 0.49 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.604 0.24 . . . . 0.0 111.624 -179.813 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 44.61 30.07 0.48 Allowed 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 120.756 0.313 . . . . 0.0 111.51 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 30.2 m . . . . . 0 C--N 1.33 -0.252 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.864 -179.824 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo . . . . . 0 C--O 1.233 0.225 0 CA-C-O 120.682 0.201 . . . . 0.0 112.297 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -63.58 161.21 32.66 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.509 2.139 . . . . 0.0 112.214 179.884 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 46.78 70.85 0.61 Allowed Glycine 0 CA--C 1.518 0.23 0 C-N-CA 120.957 -0.639 . . . . 0.0 112.66 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -151.2 -177.28 5.95 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.894 0.378 . . . . 0.0 111.046 -179.785 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.671 ' HB3' ' HB3' ' A' ' 45' ' ' ALA . 0.8 OUTLIER -107.25 69.59 0.76 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.959 -179.954 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.466 ' HB3' ' H ' ' A' ' 23' ' ' CYS . 0.2 OUTLIER 49.88 -96.41 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.795 -0.639 . . . . 0.0 112.256 179.585 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.602 ' C ' ' H ' ' A' ' 44' ' ' CYS . 0.9 OUTLIER -158.66 30.76 0.23 Allowed 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 113.268 0.84 . . . . 0.0 113.268 -178.485 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.548 ' CE1' ' HA ' ' A' ' 58' ' ' THR . 0.1 OUTLIER 55.07 161.21 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 118.2 0.454 . . . . 0.0 110.788 178.624 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -150.93 63.32 0.92 Allowed 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.503 0.557 . . . . 0.0 112.503 179.841 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -51.02 132.93 27.69 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.087 0.47 . . . . 0.0 111.62 179.853 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 2.7 ptp -152.96 110.34 3.53 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.342 179.578 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' TRP . . . . . 0.414 ' O ' ' N ' ' A' ' 30' ' ' ASP . 26.4 t90 -79.89 -78.77 0.16 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.583 -179.314 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . 0.443 ' O ' ' O ' ' A' ' 30' ' ' ASP . 2.4 t 52.62 -89.98 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.303 -178.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.443 ' O ' ' O ' ' A' ' 29' ' ' CYS . 82.9 m-20 44.93 -177.31 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 120.953 0.406 . . . . 0.0 111.894 179.223 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . 39.45 -145.72 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.405 179.757 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -92.49 44.72 1.17 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.872 0.367 . . . . 0.0 110.889 179.707 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 6.2 p -55.66 125.49 21.37 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.796 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 2.8 m -48.22 -52.94 18.78 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.513 -179.679 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.428 ' CB ' ' HB2' ' A' ' 70' ' ' LYS . 1.3 m -137.79 166.96 22.72 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.041 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 2.5 mtm-85 -89.32 108.66 19.75 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.899 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.402 ' N ' ' HB3' ' A' ' 70' ' ' LYS . . . 163.46 -163.54 35.69 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.404 -0.903 . . . . 0.0 112.579 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.436 ' HB2' ' HG2' ' A' ' 70' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.294 0 CA-C-O 120.686 0.279 . . . . 0.0 110.702 -179.816 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.555 0 N-CA-C 114.358 0.503 . . . . 0.0 114.358 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.602 ' H ' ' C ' ' A' ' 23' ' ' CYS . 87.6 m 58.69 114.93 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 117.128 0.464 . . . . 0.0 111.611 179.122 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.671 ' HB3' ' HB3' ' A' ' 21' ' ' ASN . . . -85.84 169.65 13.14 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.964 179.639 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -110.34 -39.28 5.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.821 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.702 HG23 ' CD ' ' A' ' 49' ' ' PRO . 11.7 t -138.53 164.3 29.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.112 179.724 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.615 ' N ' ' HD3' ' A' ' 49' ' ' PRO . 0.9 OUTLIER -132.59 44.45 1.33 Allowed Pre-proline 0 CA--C 1.532 0.254 0 N-CA-C 112.762 0.652 . . . . 0.0 112.762 -179.077 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.702 ' CD ' HG23 ' A' ' 47' ' ' THR . 55.4 Cg_endo -91.43 18.38 1.22 Allowed 'Trans proline' 0 N--CA 1.455 -0.789 0 C-N-CA 122.517 2.144 . . . . 0.0 110.518 177.817 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.462 ' O ' ' CD ' ' A' ' 52' ' ' LYS . 9.8 t -105.71 -112.99 0.26 Allowed 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 115.283 -0.871 . . . . 0.0 111.427 -178.412 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.436 ' CG ' ' O ' ' A' ' 50' ' ' SER . 0.6 OUTLIER 51.99 24.94 2.85 Favored 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 122.437 0.295 . . . . 0.0 111.681 -179.847 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.711 ' HB2' ' HD3' ' A' ' 53' ' ' PRO . 0.3 OUTLIER -143.3 -54.19 0.02 OUTLIER Pre-proline 0 CA--C 1.533 0.301 0 N-CA-C 111.935 0.346 . . . . 0.0 111.935 179.527 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . 0.711 ' HD3' ' HB2' ' A' ' 52' ' ' LYS . 15.3 Cg_exo -69.3 153.62 70.76 Favored 'Trans proline' 0 C--N 1.35 0.639 0 C-N-CA 122.253 1.969 . . . . 0.0 112.565 -179.633 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.468 0.439 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.505 179.777 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.548 ' HA ' ' CE1' ' A' ' 24' ' ' TYR . 0.2 OUTLIER . . . . . 0 CA--C 1.52 -0.186 0 CA-C-O 120.422 0.153 . . . . 0.0 110.902 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . 0.479 ' SG ' ' O ' ' A' ' 58' ' ' THR . 15.4 m -167.94 158.51 10.65 Favored 'General case' 0 CA--C 1.528 0.117 0 CA-C-O 121.741 0.781 . . . . 0.0 112.814 179.716 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.44 ' O ' ' HB2' ' A' ' 22' ' ' LEU . 0.2 OUTLIER 170.47 129.35 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 114.241 -1.345 . . . . 0.0 109.159 178.646 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.456 ' HA ' ' CG ' ' A' ' 22' ' ' LEU . 16.1 p -176.78 170.55 2.34 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.916 0.388 . . . . 0.0 111.336 -179.238 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER 48.73 38.2 11.2 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.45 179.803 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 179.01 -174.64 0.19 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.769 179.813 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.512 ' HE3' HG12 ' A' ' 2' ' ' VAL . 12.8 mmtm -101.91 17.99 21.73 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.221 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . 0.417 ' HB2' ' O ' ' A' ' 64' ' ' LYS . 56.3 m 68.25 -49.62 0.55 Allowed 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 112.361 0.504 . . . . 0.0 112.361 179.499 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.44 ' ND2' ' HB2' ' A' ' 64' ' ' LYS . 10.3 p30 -32.53 98.18 0.12 Allowed Pre-proline 0 N--CA 1.469 0.522 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 -179.728 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -83.72 -101.73 0.0 OUTLIER 'Trans proline' 0 CA--C 1.536 0.598 0 C-N-CA 122.708 2.272 . . . . 0.0 112.348 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.408 ' HA ' ' HD3' ' A' ' 69' ' ' PRO . 1.8 t-80 175.47 132.08 0.15 Allowed Pre-proline 0 CA--C 1.531 0.228 0 O-C-N 122.343 -0.223 . . . . 0.0 110.875 179.836 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 68' ' ' HIS . 33.6 Cg_exo -59.97 155.22 45.62 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.511 2.141 . . . . 0.0 112.41 179.9 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.436 ' HG2' ' HB2' ' A' ' 38' ' ' LYS . 0.0 OUTLIER -97.5 -34.31 11.05 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.754 179.609 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.331 -0.215 0 CA-C-O 120.904 0.383 . . . . 0.0 110.725 179.725 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 192' ' ' CYS . . . . . 0.698 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.0 OUTLIER . . . . . 0 CA--C 1.499 -1.009 0 CA-C-O 121.629 0.728 . . . . 0.0 111.559 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 193' ' ' CYS . . . . . 0.698 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.0 OUTLIER 46.96 112.95 0.0 OUTLIER Pre-proline 0 C--N 1.315 -0.933 0 CA-C-N 113.552 -1.658 . . . . 0.0 112.512 173.636 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 194' ' ' PRO . . . . . . . . . . . . . 80.3 Cg_exo -42.22 162.88 0.04 OUTLIER 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.709 2.273 . . . . 0.0 112.622 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -94.34 -15.23 24.58 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.792 -179.45 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 196' ' ' THR . . . . . 0.551 ' C ' ' H ' ' B' ' 198' ' ' TYR . 27.3 p -122.02 40.3 0.44 Allowed Pre-proline 0 C--N 1.331 -0.235 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 197' ' ' PRO . . . . . 0.544 ' CD ' ' N ' ' B' ' 196' ' ' THR . 94.2 Cg_endo -76.25 15.39 0.99 Allowed 'Trans proline' 0 N--CA 1.458 -0.59 0 C-N-CA 121.757 1.638 . . . . 0.0 108.906 176.123 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 198' ' ' TYR . . . . . 0.551 ' H ' ' C ' ' B' ' 196' ' ' THR . 46.5 t80 . . . . . 0 C--O 1.249 1.066 0 CA-C-N 113.947 -1.479 . . . . 0.0 111.338 -178.811 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 1' ' ' ILE . . . . . 0.525 HG23 ' HA ' ' A' ' 62' ' ' THR . 27.4 mm . . . . . 0 N--CA 1.486 1.352 0 CA-C-O 120.761 0.315 . . . . 0.0 111.026 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . 0.663 HG13 ' CD2' ' A' ' 4' ' ' HIS . 8.2 p -176.9 150.02 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.876 -179.908 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.483 ' C ' ' CG ' ' A' ' 4' ' ' HIS . 3.8 p -111.99 -28.12 8.15 Favored 'General case' 0 C--O 1.224 -0.252 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 -179.193 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' HIS . . . . . 0.663 ' CD2' HG13 ' A' ' 2' ' ' VAL . 0.0 OUTLIER 57.67 162.27 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.892 0.377 . . . . 0.0 110.682 -179.495 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.4 m -96.4 35.93 1.42 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.485 -179.641 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.473 ' HB ' ' HB2' ' A' ' 66' ' ' ASN . 24.0 m -37.75 -34.5 0.11 Allowed 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.135 -179.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.523 ' C ' HG23 ' A' ' 8' ' ' THR . . . 34.79 80.66 0.02 OUTLIER 'General case' 0 N--CA 1.461 0.084 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.316 179.745 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.523 HG23 ' C ' ' A' ' 7' ' ' ALA . 1.9 p . . . . . 0 C--N 1.33 -0.252 0 CA-C-N 115.749 -0.659 . . . . 0.0 111.236 -179.546 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.56 ' N ' ' CD ' ' A' ' 18' ' ' PRO . 61.6 Cg_endo . . . . . 0 CA--C 1.541 0.839 0 N-CA-C 115.284 1.225 . . . . 0.0 115.284 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.56 ' CD ' ' N ' ' A' ' 17' ' ' PRO . 89.2 Cg_endo -82.96 -168.39 0.58 Allowed 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 121.659 1.572 . . . . 0.0 112.111 179.807 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -65.03 79.4 0.07 OUTLIER Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.55 -0.834 . . . . 0.0 111.967 179.669 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 66.42 118.08 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.903 0.382 . . . . 0.0 110.436 -179.47 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.467 ' O ' ' HB2' ' A' ' 22' ' ' LEU . 1.7 t-20 -146.05 -63.21 0.32 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.668 -179.735 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.773 HD13 ' HB3' ' A' ' 61' ' ' SER . 2.4 mm? 70.7 108.72 0.06 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.276 179.586 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.587 ' HA ' ' HA ' ' A' ' 44' ' ' CYS . 5.5 m -64.08 65.34 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 115.901 -0.591 . . . . 0.0 111.639 -179.784 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.57 ' CG ' ' HB2' ' A' ' 45' ' ' ALA . 0.1 OUTLIER -22.72 138.1 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 123.54 0.736 . . . . 0.0 112.639 179.985 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -128.29 110.38 12.33 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.536 -179.683 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 1.5 ptpt -114.14 114.28 25.84 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.298 179.265 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -137.49 97.59 3.5 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.975 0.417 . . . . 0.0 111.272 -179.656 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -70.21 -165.8 0.11 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.741 179.453 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . 0.449 ' HB3' ' HA ' ' A' ' 33' ' ' CYS . 0.0 OUTLIER -132.22 -167.53 1.9 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.863 -179.249 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -90.31 -49.64 6.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.174 -179.816 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -155.5 -75.31 0.1 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.382 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.406 ' O ' ' CD2' ' A' ' 32' ' ' PHE . 33.7 t80 -90.44 14.08 13.94 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.42 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.449 ' HA ' ' HB3' ' A' ' 29' ' ' CYS . 93.9 m 48.84 79.67 0.07 Allowed 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.771 0.32 . . . . 0.0 111.088 -179.899 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 5.6 p -135.16 42.7 2.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.041 -179.831 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 60.84 35.22 19.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.014 179.831 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -129.76 31.08 4.79 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.871 179.889 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -104.81 -168.7 24.34 Favored Glycine 0 C--N 1.331 0.266 0 C-N-CA 120.83 -0.7 . . . . 0.0 112.643 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.243 0 CA-C-O 120.737 0.303 . . . . 0.0 111.048 -179.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.52 0.383 0 N-CA-C 114.407 0.523 . . . . 0.0 114.407 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.587 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 0.0 OUTLIER 57.32 157.87 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 117.373 0.587 . . . . 0.0 112.327 178.612 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.585 ' O ' ' HB3' ' A' ' 46' ' ' ALA . . . -151.11 -39.27 0.12 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.465 -0.788 . . . . 0.0 111.466 -179.718 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.585 ' HB3' ' O ' ' A' ' 45' ' ' ALA . . . 80.85 40.52 0.06 Allowed 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.975 -179.766 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.431 ' O ' HG23 ' A' ' 47' ' ' THR . 4.6 t -165.77 77.48 0.26 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.67 179.786 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.542 ' N ' ' HD2' ' A' ' 49' ' ' PRO . 52.9 t -69.07 -48.88 26.74 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.417 -179.737 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.542 ' HD2' ' N ' ' A' ' 48' ' ' CYS . 52.0 Cg_endo -69.89 58.95 1.66 Allowed 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 121.705 1.603 . . . . 0.0 110.04 178.628 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.426 ' N ' ' O ' ' A' ' 48' ' ' CYS . 42.8 t -110.0 -109.01 0.34 Allowed 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 114.977 -1.01 . . . . 0.0 111.057 -178.159 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.41 ' HG3' ' O ' ' A' ' 50' ' ' SER . 0.4 OUTLIER 36.17 77.54 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.323 0 N-CA-C 112.149 0.425 . . . . 0.0 112.149 179.808 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.55 ' HB2' ' HD3' ' A' ' 53' ' ' PRO . 0.0 OUTLIER -104.26 -56.4 0.09 OUTLIER Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.611 179.366 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . 0.55 ' HD3' ' HB2' ' A' ' 52' ' ' LYS . 11.8 Cg_endo -93.29 171.23 2.07 Favored 'Trans proline' 0 N--CA 1.453 -0.908 0 C-N-CA 123.167 2.578 . . . . 0.0 111.749 179.69 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.469 0.487 0 CA-C-O 120.842 0.353 . . . . 0.0 110.722 179.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 89.0 m . . . . . 0 N--CA 1.454 -0.266 0 CA-C-O 120.655 0.264 . . . . 0.0 111.013 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . 0.42 ' HB2' ' HG ' ' A' ' 22' ' ' LEU . 0.6 OUTLIER -43.44 133.75 4.2 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.89 179.773 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.571 ' HB2' ' O ' ' A' ' 23' ' ' CYS . 0.5 OUTLIER -114.97 -94.58 0.47 Allowed 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.905 -178.846 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.773 ' HB3' HD13 ' A' ' 22' ' ' LEU . 2.3 t 64.07 -76.48 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.79 0.329 . . . . 0.0 111.567 -179.848 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.525 ' HA ' HG23 ' A' ' 1' ' ' ILE . 9.3 t -44.22 134.05 5.07 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.135 -0.484 . . . . 0.0 112.044 -179.054 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 56.17 173.15 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.718 -0.673 . . . . 0.0 111.586 179.384 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.75 84.75 0.11 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.039 179.605 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -93.37 16.96 12.15 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.074 -0.512 . . . . 0.0 112.311 -178.705 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.481 ' ND2' ' O ' ' A' ' 3' ' ' CYS . 0.7 OUTLIER -54.04 163.16 1.25 Allowed Pre-proline 0 N--CA 1.465 0.275 0 CA-C-O 120.908 0.385 . . . . 0.0 111.15 179.841 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_exo -51.25 124.89 15.04 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.709 2.273 . . . . 0.0 112.307 179.78 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 11.8 m-70 -133.75 99.78 13.83 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.856 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -48.81 165.66 0.17 Allowed 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.571 2.181 . . . . 0.0 112.46 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.8 ptmt -114.83 -30.1 6.54 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.976 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 . . . . . 0 C--N 1.33 -0.247 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.37 179.866 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 192' ' ' CYS . . . . . 0.705 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.1 OUTLIER . . . . . 0 CA--C 1.5 -0.944 0 CA-C-O 121.506 0.67 . . . . 0.0 112.149 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 193' ' ' CYS . . . . . 0.705 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.0 OUTLIER -162.45 163.37 18.36 Favored Pre-proline 0 N--CA 1.436 -1.161 0 CA-C-N 114.278 -1.328 . . . . 0.0 111.752 -173.46 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 194' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -82.74 130.99 6.07 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.768 2.312 . . . . 0.0 112.051 179.604 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -63.84 80.81 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.02 -179.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 196' ' ' THR . . . . . 0.687 ' N ' ' CD ' ' B' ' 197' ' ' PRO . 0.7 OUTLIER -118.34 5.43 0.08 OUTLIER Pre-proline 0 C--N 1.328 -0.328 0 N-CA-C 113.763 1.023 . . . . 0.0 113.763 -179.636 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 197' ' ' PRO . . . . . 0.687 ' CD ' ' N ' ' B' ' 196' ' ' THR . 73.9 Cg_endo -74.04 21.93 0.37 Allowed 'Trans proline' 0 C--N 1.354 0.827 0 CA-C-N 120.53 1.225 . . . . 0.0 109.042 176.471 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 198' ' ' TYR . . . . . 0.646 ' H ' ' C ' ' B' ' 196' ' ' THR . 0.2 OUTLIER . . . . . 0 C--O 1.25 1.081 0 CA-C-N 114.058 -1.428 . . . . 0.0 111.379 -178.753 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 1' ' ' ILE . . . . . 0.579 ' N ' HD13 ' A' ' 1' ' ' ILE . 0.1 OUTLIER . . . . . 0 N--CA 1.485 1.313 0 CA-C-O 120.94 0.4 . . . . 0.0 111.132 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . 0.428 ' O ' ' HA ' ' A' ' 64' ' ' LYS . 3.7 m -98.98 -171.02 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.735 179.751 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -148.14 88.33 1.65 Allowed 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 111.773 0.286 . . . . 0.0 111.773 -179.667 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' HIS . . . . . 0.494 ' CE1' ' HB2' ' A' ' 64' ' ' LYS . 4.9 p-80 -59.0 126.79 29.17 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.888 0.375 . . . . 0.0 110.23 179.299 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 75.0 p -47.21 -74.7 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.483 -179.395 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 63.8 p 50.45 23.82 1.39 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.928 179.656 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -120.38 -161.12 0.86 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.564 -0.289 . . . . 0.0 110.327 179.436 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 1.3 t . . . . . 0 N--CA 1.462 0.146 0 CA-C-O 120.869 0.366 . . . . 0.0 110.066 179.45 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_exo . . . . . 0 CA--C 1.529 0.263 0 N-CA-C 113.018 0.353 . . . . 0.0 113.018 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_exo -57.17 -160.25 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.724 2.283 . . . . 0.0 112.475 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 64.17 -86.67 0.07 OUTLIER Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.675 -0.774 . . . . 0.0 112.137 -179.809 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -105.07 142.32 35.06 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 110.252 -0.277 . . . . 0.0 110.252 179.53 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.408 ' HB3' ' N ' ' A' ' 45' ' ' ALA . 1.5 m-20 64.14 88.86 0.1 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.437 -179.617 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.466 ' HG ' ' CB ' ' A' ' 61' ' ' SER . 0.6 OUTLIER -73.66 -80.32 0.07 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.478 -179.49 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 8.4 m -158.52 29.04 0.23 Allowed 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 120.602 0.239 . . . . 0.0 111.546 -178.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.769 ' CD1' ' HB3' ' A' ' 45' ' ' ALA . 0.0 OUTLIER -83.49 161.93 21.09 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.075 0.464 . . . . 0.0 111.728 -178.973 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.469 ' N ' ' CG ' ' A' ' 24' ' ' TYR . 0.9 OUTLIER -168.73 -79.08 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 115.718 -0.673 . . . . 0.0 110.973 178.889 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 177.7 165.97 0.66 Allowed 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.646 0.26 . . . . 0.0 110.767 179.844 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -152.09 -167.18 2.69 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.143 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' TRP . . . . . 0.421 ' HA ' ' CE3' ' A' ' 28' ' ' TRP . 2.5 t-105 -148.38 179.02 8.1 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.447 179.756 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -173.59 99.32 0.11 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.837 0.351 . . . . 0.0 111.117 -179.901 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 50.2 t0 -66.05 137.51 57.13 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.555 179.728 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . 59.22 -156.29 0.34 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.524 -179.751 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 14.1 m-85 -82.59 53.11 2.25 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.823 0.344 . . . . 0.0 110.904 179.785 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 56.9 m 44.95 30.06 0.53 Allowed 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.308 -179.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 92.3 p -82.24 -31.67 30.09 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.62 179.824 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -130.15 114.67 16.01 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.621 179.78 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 33.1 mmm-85 -57.12 133.89 55.39 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.229 -179.732 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.406 ' C ' ' HG2' ' A' ' 38' ' ' LYS . . . -113.65 44.71 1.44 Allowed Glycine 0 C--N 1.33 0.248 0 C-N-CA 120.824 -0.703 . . . . 0.0 112.586 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.428 ' O ' ' HG3' ' A' ' 70' ' ' LYS . 0.2 OUTLIER . . . . . 0 CA--C 1.531 0.223 0 C-N-CA 122.218 0.207 . . . . 0.0 111.402 179.767 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . 0.427 ' N ' ' HB2' ' A' ' 25' ' ' ARG . . . . . . . . 0 N--CA 1.45 -0.388 0 N-CA-C 112.736 -0.146 . . . . 0.0 112.736 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.434 ' O ' ' HB2' ' A' ' 45' ' ' ALA . 3.3 m 62.65 147.62 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.897 0.38 . . . . 0.0 111.333 179.249 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.769 ' HB3' ' CD1' ' A' ' 24' ' ' TYR . . . 175.97 137.3 0.05 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.769 179.345 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -70.27 67.96 0.33 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.051 0.453 . . . . 0.0 110.795 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.816 HG22 ' HD3' ' A' ' 49' ' ' PRO . 89.0 m -164.77 147.09 8.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.817 -179.62 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -131.6 67.3 79.79 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.899 179.928 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.816 ' HD3' HG22 ' A' ' 47' ' ' THR . 32.6 Cg_exo -60.94 -11.22 17.22 Favored 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 122.466 2.111 . . . . 0.0 111.659 178.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 32.4 t -39.33 -68.7 0.15 Allowed 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 115.598 -0.728 . . . . 0.0 112.336 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 16.6 ptmt -90.69 77.16 6.37 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 120.923 0.392 . . . . 0.0 111.718 -179.238 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.624 ' HB3' ' CD ' ' A' ' 53' ' ' PRO . 0.6 OUTLIER -148.34 -167.11 0.15 Allowed Pre-proline 0 CA--C 1.538 0.494 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 179.682 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . 0.624 ' CD ' ' HB3' ' A' ' 52' ' ' LYS . 76.0 Cg_exo -51.96 -142.33 0.0 OUTLIER 'Trans proline' 0 C--N 1.356 0.947 0 C-N-CA 122.445 2.097 . . . . 0.0 113.198 -179.461 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.471 0.585 0 CA-C-O 120.83 0.347 . . . . 0.0 111.782 -179.059 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 10.7 p . . . . . 0 C--O 1.232 0.14 0 CA-C-O 120.974 0.416 . . . . 0.0 110.14 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . 0.565 ' O ' ' CB ' ' A' ' 60' ' ' CYS . 80.4 m 56.06 -116.51 1.02 Allowed 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.802 -179.316 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.565 ' CB ' ' O ' ' A' ' 59' ' ' CYS . 2.4 m 139.17 47.07 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.476 0.71 . . . . 0.0 109.889 179.401 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.466 ' CB ' ' HG ' ' A' ' 22' ' ' LEU . 79.3 p -115.73 160.55 19.94 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.334 -179.424 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 1.3 m 73.84 17.68 3.51 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.934 -0.576 . . . . 0.0 111.635 179.732 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.9 p30 171.18 167.93 0.08 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 120.687 0.28 . . . . 0.0 110.909 179.71 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.494 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 0.0 OUTLIER -56.96 -32.79 66.39 Favored 'General case' 0 CA--C 1.516 -0.352 0 CA-C-O 121.498 0.666 . . . . 0.0 110.913 179.827 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . 0.408 ' HB3' ' O ' ' A' ' 64' ' ' LYS . 43.6 t 72.32 -44.36 0.59 Allowed 'General case' 0 C--N 1.313 -0.986 0 CA-C-N 114.727 -1.124 . . . . 0.0 112.689 179.03 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.455 ' HB2' ' NE2' ' A' ' 4' ' ' HIS . 0.3 OUTLIER -40.07 97.35 0.13 Allowed Pre-proline 0 N--CA 1.47 0.543 0 CA-C-O 120.697 0.284 . . . . 0.0 111.532 -178.92 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . 0.459 ' O ' ' CG ' ' A' ' 68' ' ' HIS . 6.7 Cg_exo -73.88 -2.24 11.96 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.953 2.435 . . . . 0.0 112.711 -179.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.459 ' CG ' ' O ' ' A' ' 67' ' ' PRO . 3.4 p80 55.98 168.49 0.05 OUTLIER Pre-proline 0 CA--C 1.53 0.202 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.085 -179.824 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 77.2 Cg_exo -50.53 114.42 1.45 Allowed 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.531 2.154 . . . . 0.0 112.325 -179.869 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.428 ' HG3' ' O ' ' A' ' 38' ' ' LYS . 2.3 mtmm -61.52 -61.68 2.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.948 -179.925 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.4 ' HA ' ' CD ' ' A' ' 38' ' ' LYS . 1.3 tt0 . . . . . 0 CA--C 1.533 0.291 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.349 179.745 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 192' ' ' CYS . . . . . 0.687 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.0 OUTLIER . . . . . 0 CA--C 1.496 -1.113 0 CA-C-O 121.955 0.883 . . . . 0.0 111.352 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 193' ' ' CYS . . . . . 0.687 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.1 OUTLIER 40.02 89.53 0.08 OUTLIER Pre-proline 0 N--CA 1.439 -0.983 0 CA-C-N 113.23 -1.805 . . . . 0.0 112.257 173.774 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 194' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_exo -49.07 176.93 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.61 2.206 . . . . 0.0 112.375 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -65.55 76.27 0.07 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.121 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 196' ' ' THR . . . . . 0.697 ' N ' ' HD3' ' B' ' 197' ' ' PRO . 9.7 t -150.14 45.56 0.36 Allowed Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.934 179.862 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 197' ' ' PRO . . . . . 0.697 ' HD3' ' N ' ' B' ' 196' ' ' THR . 3.7 Cg_exo -76.27 13.55 1.3 Allowed 'Trans proline' 0 C--N 1.351 0.68 0 C-N-CA 121.797 1.665 . . . . 0.0 108.572 175.894 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 198' ' ' TYR . . . . . 0.556 ' H ' ' C ' ' B' ' 196' ' ' THR . 43.6 t80 . . . . . 0 C--O 1.249 1.075 0 CA-C-N 113.766 -1.561 . . . . 0.0 111.237 -178.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 2.8 pp . . . . . 0 N--CA 1.486 1.369 0 CA-C-O 120.789 0.328 . . . . 0.0 111.143 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 22.5 t -144.91 148.46 17.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.55 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -97.31 -156.79 0.55 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.776 179.81 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' HIS . . . . . 0.508 ' CD2' ' HA ' ' A' ' 64' ' ' LYS . 2.2 p80 -123.89 151.25 43.71 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 178.745 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 42.9 p -60.14 114.17 2.73 Favored 'General case' 0 N--CA 1.439 -0.979 0 CA-C-O 121.554 0.692 . . . . 0.0 111.974 -178.43 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.598 ' O ' HG22 ' A' ' 6' ' ' THR . 64.5 m -151.39 27.95 0.65 Allowed 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 114.706 -1.134 . . . . 0.0 108.835 178.944 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -39.31 -31.7 0.09 Allowed 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 115.346 -0.843 . . . . 0.0 112.357 -179.146 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 88.1 m . . . . . 0 C--N 1.329 -0.292 0 CA-C-O 120.78 0.324 . . . . 0.0 111.209 -179.796 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_endo . . . . . 0 CA--C 1.529 0.259 0 CA-C-O 120.654 0.189 . . . . 0.0 112.471 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_exo -48.78 162.25 0.4 Allowed 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.612 2.208 . . . . 0.0 112.28 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 62.69 124.15 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.621 -0.799 . . . . 0.0 112.175 -179.782 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER 61.33 59.57 1.9 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.107 0.48 . . . . 0.0 110.655 -179.809 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 16.5 p-10 -155.29 96.05 1.77 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.53 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.409 ' O ' ' N ' ' A' ' 61' ' ' SER . 59.2 mt -112.79 28.16 9.02 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.615 -179.493 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.561 ' O ' ' HB3' ' A' ' 60' ' ' CYS . 7.8 t 37.08 67.44 0.35 Allowed 'General case' 0 C--O 1.222 -0.373 0 CA-C-N 116.6 -0.273 . . . . 0.0 111.608 179.331 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.85 ' CD2' ' HB2' ' A' ' 45' ' ' ALA . 0.0 OUTLIER -84.25 170.49 13.66 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 121.204 0.526 . . . . 0.0 112.366 -179.002 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 174.57 150.75 0.09 Allowed 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.477 -179.67 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.584 ' O ' ' CB ' ' A' ' 27' ' ' MET . 0.1 OUTLIER -144.83 -83.48 0.14 Allowed 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 120.765 -0.374 . . . . 0.0 111.821 179.996 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . 0.584 ' CB ' ' O ' ' A' ' 26' ' ' LYS . 5.7 ptt? 134.09 -144.84 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.989 0.916 . . . . 0.0 108.692 -179.155 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -169.9 170.46 7.71 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-O 120.71 0.29 . . . . 0.0 110.892 179.179 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 18.4 t -177.38 -77.05 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.919 179.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 170.41 -80.76 0.0 OUTLIER 'General case' 0 CA--C 1.529 0.17 0 CA-C-O 120.676 0.274 . . . . 0.0 110.992 179.875 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -161.97 -80.98 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.189 179.937 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 35.2 p90 -97.5 21.05 10.73 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.777 0.322 . . . . 0.0 111.087 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 2.3 p -75.51 125.28 28.71 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.0 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 5.5 m -62.92 -20.81 65.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.232 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 25.7 p -87.38 50.88 2.09 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.884 0.373 . . . . 0.0 111.013 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 4.6 ptt85 -67.04 81.87 0.12 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.97 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.439 ' HA3' ' HG2' ' A' ' 70' ' ' LYS . . . 163.31 -142.18 7.68 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.678 -0.773 . . . . 0.0 112.6 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.435 ' HD2' ' CD ' ' A' ' 70' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.332 -0.157 0 CA-C-O 120.523 0.202 . . . . 0.0 111.061 -179.745 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . 0.454 ' HA2' ' O ' ' A' ' 24' ' ' TYR . . . . . . . . 0 CA--C 1.52 0.359 0 N-CA-C 113.73 0.252 . . . . 0.0 113.73 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.478 ' O ' ' CE1' ' A' ' 24' ' ' TYR . 0.5 OUTLIER 59.59 129.06 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 112.392 0.516 . . . . 0.0 112.392 179.075 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.85 ' HB2' ' CD2' ' A' ' 24' ' ' TYR . . . -140.73 -164.27 1.7 Allowed 'General case' 0 N--CA 1.461 0.103 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.176 179.921 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -132.04 20.32 4.51 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.602 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.466 HG23 ' HG2' ' A' ' 49' ' ' PRO . 1.5 m -178.58 124.07 0.1 Allowed 'General case' 0 CA--C 1.53 0.194 0 CA-C-O 120.777 0.322 . . . . 0.0 110.89 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.639 ' O ' ' N ' ' A' ' 50' ' ' SER . 47.5 t -77.83 -55.92 1.16 Allowed Pre-proline 0 C--N 1.332 -0.186 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.813 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.524 ' HD2' ' N ' ' A' ' 48' ' ' CYS . 4.0 Cg_exo -40.22 81.76 0.01 OUTLIER 'Trans proline' 0 C--N 1.356 0.967 0 C-N-CA 122.627 2.218 . . . . 0.0 111.411 179.842 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.639 ' N ' ' O ' ' A' ' 48' ' ' CYS . 41.1 t -131.25 8.31 4.68 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.296 -0.865 . . . . 0.0 111.541 -178.083 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 8.9 mtmt -61.93 -19.2 62.46 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.236 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.575 ' HB3' ' HD2' ' A' ' 53' ' ' PRO . 0.0 OUTLIER -57.15 179.64 0.13 Allowed Pre-proline 0 C--N 1.331 -0.227 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.311 179.894 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . 0.575 ' HD2' ' HB3' ' A' ' 52' ' ' LYS . 97.8 Cg_exo -45.14 -45.72 14.3 Favored 'Trans proline' 0 C--N 1.349 0.587 0 C-N-CA 122.353 2.036 . . . . 0.0 112.484 -179.833 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . 0.476 ' CE2' ' HB2' ' A' ' 52' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.468 0.429 0 CA-C-O 121.065 0.459 . . . . 0.0 110.63 179.705 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 11.5 t . . . . . 0 C--O 1.232 0.164 0 N-CA-C 110.313 -0.254 . . . . 0.0 110.313 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 31.8 p -45.94 123.57 4.63 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 120.989 0.423 . . . . 0.0 111.381 -179.497 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.561 ' HB3' ' O ' ' A' ' 23' ' ' CYS . 0.1 OUTLIER -131.25 44.55 2.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.423 -179.707 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.409 ' N ' ' O ' ' A' ' 22' ' ' LEU . 8.8 p -80.81 132.2 35.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.355 -179.41 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.588 HG22 ' N ' ' A' ' 63' ' ' ASP . 1.2 m 177.21 -74.4 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.159 179.811 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . 0.588 ' N ' HG22 ' A' ' 62' ' ' THR . 67.9 t0 179.99 -37.76 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.595 179.846 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.508 ' HA ' ' CD2' ' A' ' 4' ' ' HIS . 1.5 mtpt -131.1 79.09 1.87 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.607 179.83 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . 0.461 ' HB3' ' HB3' ' A' ' 60' ' ' CYS . 0.0 OUTLIER -137.98 7.0 2.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.875 -179.718 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.506 ' HB2' ' HD2' ' A' ' 67' ' ' PRO . 0.1 OUTLIER -57.61 166.63 1.68 Allowed Pre-proline 0 N--CA 1.462 0.162 0 CA-C-O 120.493 0.187 . . . . 0.0 110.695 -179.991 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . 0.506 ' HD2' ' HB2' ' A' ' 66' ' ' ASN . 88.6 Cg_exo -44.72 162.96 0.07 OUTLIER 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.409 2.073 . . . . 0.0 112.161 179.688 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -176.24 64.05 0.22 Allowed Pre-proline 0 C--N 1.326 -0.427 0 CA-C-O 120.894 0.378 . . . . 0.0 111.068 -179.605 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -49.57 129.59 23.75 Favored 'Trans proline' 0 C--N 1.344 0.31 0 C-N-CA 122.594 2.196 . . . . 0.0 111.751 179.556 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.503 ' O ' ' C ' ' A' ' 71' ' ' GLN . 0.4 OUTLIER -69.94 -47.25 63.12 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 120.836 -0.346 . . . . 0.0 111.564 -179.231 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.503 ' C ' ' O ' ' A' ' 70' ' ' LYS . 2.2 tt0 . . . . . 0 N--CA 1.471 0.616 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 179.743 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 192' ' ' CYS . . . . . 0.685 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.1 OUTLIER . . . . . 0 CA--C 1.499 -0.993 0 CA-C-O 122.252 1.025 . . . . 0.0 111.972 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 193' ' ' CYS . . . . . 0.685 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.1 OUTLIER 36.27 92.71 0.05 OUTLIER Pre-proline 0 C--N 1.314 -0.955 0 CA-C-N 112.795 -2.002 . . . . 0.0 113.119 173.394 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 194' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -59.27 145.03 99.1 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.592 2.195 . . . . 0.0 112.042 179.549 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 78.6 m-20 -131.35 12.17 5.0 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.515 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 196' ' ' THR . . . . . 0.59 ' N ' ' CD ' ' B' ' 197' ' ' PRO . 0.2 OUTLIER -122.26 35.4 0.26 Allowed Pre-proline 0 C--N 1.33 -0.27 0 N-CA-C 112.096 0.406 . . . . 0.0 112.096 179.873 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 197' ' ' PRO . . . . . 0.59 ' CD ' ' N ' ' B' ' 196' ' ' THR . 77.9 Cg_endo -74.73 15.7 0.68 Allowed 'Trans proline' 0 C--N 1.35 0.638 0 C-N-CA 121.551 1.501 . . . . 0.0 108.967 176.203 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 198' ' ' TYR . . . . . 0.589 ' H ' ' C ' ' B' ' 196' ' ' THR . 7.9 t80 . . . . . 0 C--O 1.249 1.028 0 CA-C-N 114.033 -1.44 . . . . 0.0 111.25 -178.741 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 1' ' ' ILE . . . . . 0.574 HG23 ' O ' ' A' ' 62' ' ' THR . 5.1 mp . . . . . 0 N--CA 1.485 1.322 0 CA-C-O 120.421 0.153 . . . . 0.0 111.13 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . 0.481 HG22 ' O ' ' A' ' 1' ' ' ILE . 33.3 m 45.82 -179.34 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.312 0 CA-C-O 120.897 0.379 . . . . 0.0 111.865 -179.788 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 55.9 m -128.78 -139.76 0.24 Allowed 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.999 -179.165 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' HIS . . . . . 0.431 ' CE1' ' ND2' ' A' ' 66' ' ' ASN . 0.3 OUTLIER -109.48 -95.77 0.4 Allowed 'General case' 0 CA--C 1.53 0.188 0 O-C-N 122.406 -0.184 . . . . 0.0 110.53 179.926 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.3 t -145.13 145.66 31.48 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.974 0.416 . . . . 0.0 110.916 179.396 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.839 HG21 ' HA2' ' A' ' 43' ' ' GLY . 9.6 p -103.19 77.92 1.58 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.892 -179.81 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.498 ' O ' HG23 ' A' ' 8' ' ' THR . . . -177.96 -68.67 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.174 -179.875 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.498 HG23 ' O ' ' A' ' 7' ' ' ALA . 0.6 OUTLIER . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.797 -179.817 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.488 ' N ' ' HD2' ' A' ' 18' ' ' PRO . 35.6 Cg_exo . . . . . 0 CA--C 1.531 0.37 0 N-CA-C 113.42 0.508 . . . . 0.0 113.42 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.488 ' HD2' ' N ' ' A' ' 17' ' ' PRO . 37.3 Cg_exo -38.2 -44.08 1.88 Allowed 'Trans proline' 0 C--N 1.349 0.593 0 C-N-CA 122.918 2.412 . . . . 0.0 113.401 -179.259 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -107.93 -136.22 7.89 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.476 -0.868 . . . . 0.0 113.143 -179.692 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.562 ' CB ' ' HA ' ' A' ' 46' ' ' ALA . 0.3 OUTLIER -35.71 -42.94 0.27 Allowed 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 112.937 0.717 . . . . 0.0 112.937 -179.347 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.416 ' N ' ' HG2' ' A' ' 20' ' ' GLU . 0.1 OUTLIER 79.19 -52.52 0.44 Allowed 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 114.845 -1.07 . . . . 0.0 110.926 -179.398 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.783 ' O ' ' HA ' ' A' ' 44' ' ' CYS . 0.4 OUTLIER -59.72 118.25 5.93 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 179.368 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.565 ' HA ' ' HA ' ' A' ' 44' ' ' CYS . 6.0 m -80.44 39.7 0.47 Allowed 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 113.091 0.775 . . . . 0.0 113.091 -178.514 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.541 ' CG ' ' HB2' ' A' ' 45' ' ' ALA . 0.1 OUTLIER 43.67 -165.58 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.375 0 CA-C-O 120.71 0.29 . . . . 0.0 111.204 179.55 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.543 ' CB ' HG23 ' A' ' 58' ' ' THR . 0.1 OUTLIER -179.97 90.2 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.979 -0.288 . . . . 0.0 111.615 179.717 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 4.8 mtmt -84.09 110.82 18.78 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.796 179.538 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 1.6 ttp -131.03 92.2 3.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.312 -179.803 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' TRP . . . . . 0.414 ' CE3' ' HA ' ' A' ' 28' ' ' TRP . 0.0 OUTLIER -67.12 -159.81 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.409 179.574 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 93.5 m -148.94 157.54 43.5 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.852 0.358 . . . . 0.0 110.986 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -137.71 121.02 16.97 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.676 179.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.427 ' C ' ' CG ' ' A' ' 32' ' ' PHE . . . 62.22 90.39 0.07 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.814 -179.717 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.427 ' CG ' ' C ' ' A' ' 31' ' ' ALA . 4.6 p90 44.48 30.11 0.46 Allowed 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.361 -179.79 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 9.2 t 43.55 55.75 4.78 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.37 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -156.74 28.38 0.32 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.657 179.803 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.429 ' O ' ' C ' ' A' ' 36' ' ' ARG . 43.2 m -138.24 37.86 2.3 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.585 -179.891 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.446 ' HG3' ' HB2' ' A' ' 70' ' ' LYS . 0.2 OUTLIER 25.84 89.77 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 115.739 -0.664 . . . . 0.0 112.275 179.55 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.44 ' N ' ' HG3' ' A' ' 70' ' ' LYS . . . -80.06 -127.33 0.66 Allowed Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.639 -0.791 . . . . 0.0 113.315 -179.557 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.338 0 CA-C-O 120.947 0.404 . . . . 0.0 110.211 -179.302 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . 0.839 ' HA2' HG21 ' A' ' 6' ' ' THR . . . . . . . . 0 CA--C 1.515 0.089 0 N-CA-C 113.678 0.231 . . . . 0.0 113.678 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.783 ' HA ' ' O ' ' A' ' 22' ' ' LEU . 59.2 m 61.99 141.26 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.887 0.344 . . . . 0.0 111.348 179.191 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.541 ' HB2' ' CG ' ' A' ' 24' ' ' TYR . . . -130.0 -99.57 0.33 Allowed 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 112.042 0.386 . . . . 0.0 112.042 -179.557 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.562 ' HA ' ' CB ' ' A' ' 20' ' ' GLU . . . -179.33 -41.4 0.01 OUTLIER 'General case' 0 C--O 1.23 0.057 0 CA-C-O 120.906 0.384 . . . . 0.0 110.958 -179.368 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 4.7 t -178.12 45.65 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.118 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.462 ' N ' ' HD3' ' A' ' 49' ' ' PRO . 10.1 m 55.68 62.9 6.78 Favored Pre-proline 0 C--N 1.332 -0.195 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.374 179.733 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.462 ' HD3' ' N ' ' A' ' 48' ' ' CYS . 5.4 Cg_exo -76.47 3.9 5.96 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.755 2.303 . . . . 0.0 111.502 178.862 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.478 ' O ' ' HB2' ' A' ' 51' ' ' LYS . 30.3 t -51.05 -62.55 1.55 Allowed 'General case' 0 N--CA 1.455 -0.195 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.519 -179.804 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.478 ' HB2' ' O ' ' A' ' 50' ' ' SER . 9.5 mtpt 77.87 -50.28 0.5 Allowed 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.483 -179.729 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.36 133.16 20.72 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.003 -179.739 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . 0.401 ' HG2' ' CE1' ' A' ' 54' ' ' TYR . 69.2 Cg_endo -76.16 -47.94 0.15 Allowed 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.534 2.156 . . . . 0.0 112.612 -179.855 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . 0.404 ' O ' ' CZ3' ' A' ' 28' ' ' TRP . 0.0 OUTLIER . . . . . 0 N--CA 1.47 0.536 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.101 -179.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.543 HG23 ' CB ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER . . . . . 0 CA--C 1.534 0.339 0 CA-C-O 120.217 0.056 . . . . 0.0 110.992 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -151.11 160.15 44.06 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 120.94 0.4 . . . . 0.0 111.315 -179.699 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.501 ' HB2' ' O ' ' A' ' 24' ' ' TYR . 0.1 OUTLIER -138.7 -18.59 1.07 Allowed 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.609 179.846 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.657 ' O ' HG23 ' A' ' 62' ' ' THR . 83.1 p -42.8 106.33 0.06 Allowed 'General case' 0 N--CA 1.462 0.17 0 CA-C-O 120.843 0.354 . . . . 0.0 111.859 -179.503 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.657 HG23 ' O ' ' A' ' 61' ' ' SER . 4.0 p -164.84 -76.45 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.601 179.646 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 30.6 p-10 177.58 -39.31 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.704 179.821 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.414 ' O ' ' ND2' ' A' ' 66' ' ' ASN . 0.0 OUTLIER -160.81 56.52 0.31 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.998 -0.547 . . . . 0.0 110.486 179.712 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . 0.426 ' O ' ' C ' ' A' ' 66' ' ' ASN . 1.3 p -55.12 -62.73 1.47 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.366 -179.499 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.431 ' ND2' ' CE1' ' A' ' 4' ' ' HIS . 9.2 p30 29.69 62.02 0.86 Allowed Pre-proline 0 N--CA 1.468 0.466 0 C-N-CA 122.625 0.37 . . . . 0.0 111.962 -179.78 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . 0.417 ' HG2' ' HG2' ' A' ' 25' ' ' ARG . 54.0 Cg_exo -52.35 -57.21 2.24 Favored 'Trans proline' 0 C--N 1.343 0.274 0 C-N-CA 122.651 2.234 . . . . 0.0 112.8 -179.631 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.468 ' HB3' ' HD2' ' A' ' 69' ' ' PRO . 15.7 m170 62.34 161.01 0.12 Allowed Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.349 -179.671 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . 0.468 ' HD2' ' HB3' ' A' ' 68' ' ' HIS . 67.7 Cg_exo -36.23 126.07 0.37 Allowed 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 123.046 2.497 . . . . 0.0 112.791 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.446 ' HB2' ' HG3' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -57.44 -16.9 10.68 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.288 -179.977 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.332 -0.179 0 CA-C-O 120.969 0.414 . . . . 0.0 110.736 179.652 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 192' ' ' CYS . . . . . 0.7 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.5 OUTLIER . . . . . 0 CA--C 1.501 -0.939 0 CA-C-O 121.965 0.888 . . . . 0.0 112.296 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 193' ' ' CYS . . . . . 0.7 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.0 OUTLIER -150.28 107.73 3.17 Favored Pre-proline 0 N--CA 1.434 -1.227 0 CA-C-N 113.492 -1.685 . . . . 0.0 111.903 -173.736 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 194' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -76.36 178.47 7.49 Favored 'Trans proline' 0 C--N 1.348 0.522 0 C-N-CA 122.545 2.163 . . . . 0.0 112.054 179.735 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 195' ' ' ASP . . . . . 0.414 ' C ' ' HD3' ' B' ' 197' ' ' PRO . 4.8 t0 55.06 100.18 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.916 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 196' ' ' THR . . . . . 0.754 ' N ' ' HD3' ' B' ' 197' ' ' PRO . 1.8 t -112.08 20.57 0.07 OUTLIER Pre-proline 0 CA--C 1.533 0.293 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 -179.783 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 197' ' ' PRO . . . . . 0.754 ' HD3' ' N ' ' B' ' 196' ' ' THR . 6.6 Cg_exo -68.52 19.43 0.14 Allowed 'Trans proline' 0 C--N 1.358 1.068 0 CA-C-N 120.382 1.172 . . . . 0.0 109.6 176.302 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 198' ' ' TYR . . . . . 0.679 ' H ' ' C ' ' B' ' 196' ' ' THR . 64.9 t80 . . . . . 0 C--O 1.249 1.046 0 CA-C-N 114.535 -1.211 . . . . 0.0 111.248 -178.828 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 1' ' ' ILE . . . . . 0.837 HG22 ' HB2' ' A' ' 63' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.445 0 CA-C-O 120.827 0.346 . . . . 0.0 110.989 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . 0.45 ' O ' ' HB3' ' A' ' 63' ' ' ASP . 48.9 t -125.7 133.27 69.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.796 179.629 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.517 ' O ' ' C ' ' A' ' 4' ' ' HIS . 19.4 m -92.33 65.22 4.53 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -178.545 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' HIS . . . . . 0.517 ' C ' ' O ' ' A' ' 3' ' ' CYS . 0.5 OUTLIER -10.49 93.03 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 112.651 0.611 . . . . 0.0 112.651 179.596 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.422 ' O ' ' O ' ' A' ' 4' ' ' HIS . 0.0 OUTLIER 39.24 -166.07 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 115.951 -0.568 . . . . 0.0 112.042 179.492 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.601 ' O ' ' HB3' ' A' ' 7' ' ' ALA . 3.9 t -99.25 23.31 9.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.712 179.836 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.601 ' HB3' ' O ' ' A' ' 6' ' ' THR . . . 86.87 -31.3 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.624 -179.847 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.476 ' OG1' HG23 ' A' ' 6' ' ' THR . 0.2 OUTLIER . . . . . 0 C--N 1.33 -0.243 0 CA-C-O 120.673 0.273 . . . . 0.0 111.149 -179.824 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.67 ' HB2' HD12 ' A' ' 1' ' ' ILE . 9.2 Cg_endo . . . . . 0 CA--C 1.527 0.146 0 N-CA-C 112.861 0.293 . . . . 0.0 112.861 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.404 ' CD ' ' HB2' ' A' ' 21' ' ' ASN . 1.9 Cg_endo -82.16 -57.83 0.03 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.55 0 C-N-CA 122.993 2.462 . . . . 0.0 111.451 179.494 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -124.98 -40.81 0.4 Allowed Glycine 0 N--CA 1.45 -0.421 0 CA-C-N 115.836 -0.62 . . . . 0.0 112.009 179.559 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 24.9 tp10 -160.11 68.33 0.38 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.897 0.38 . . . . 0.0 110.83 179.86 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.404 ' HB2' ' CD ' ' A' ' 18' ' ' PRO . 2.9 m-80 -140.95 83.51 1.89 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.045 -179.856 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.833 HD13 ' CB ' ' A' ' 61' ' ' SER . 47.2 mt -52.29 151.54 3.9 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.814 0.34 . . . . 0.0 111.11 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.584 ' HA ' ' HA ' ' A' ' 44' ' ' CYS . 5.3 t -78.66 167.91 20.53 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.6 179.845 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.64 ' CE1' ' HB2' ' A' ' 45' ' ' ALA . 0.2 OUTLIER -121.49 -176.31 3.27 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-O 120.737 0.303 . . . . 0.0 110.902 179.851 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 4.5 ttm180 -176.28 97.76 0.06 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.254 179.889 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 2.7 mtpt -80.65 148.23 30.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.298 179.487 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -154.17 98.61 2.16 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.835 0.35 . . . . 0.0 111.605 -179.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 1.8 t90 -77.86 -144.68 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.32 179.409 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 38.5 t -176.71 -36.4 0.01 OUTLIER 'General case' 0 C--O 1.231 0.083 0 CA-C-O 120.744 0.307 . . . . 0.0 111.11 -179.814 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 1.6 t70 77.84 -61.46 0.4 Allowed 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.906 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -174.24 96.17 0.09 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.884 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER 58.88 104.62 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.405 -179.627 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -112.41 -83.56 0.59 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.277 -179.645 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 4.1 p 70.09 -60.22 0.49 Allowed 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.765 0.317 . . . . 0.0 110.639 -179.574 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -110.51 -21.77 11.99 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.964 179.794 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.59 -86.19 0.03 OUTLIER 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 116.627 -0.261 . . . . 0.0 110.945 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.403 ' O ' ' C ' ' A' ' 38' ' ' LYS . . . 73.84 -88.48 0.65 Allowed Glycine 0 C--N 1.334 0.455 0 C-N-CA 120.467 -0.873 . . . . 0.0 112.741 179.896 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.462 ' HB3' ' HB2' ' A' ' 70' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.467 0.382 0 CA-C-O 121.065 0.46 . . . . 0.0 111.872 -179.826 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.325 0 CA-C-O 120.083 -0.287 . . . . 0.0 113.376 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.584 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 0.5 OUTLIER 61.44 131.83 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.169 0.509 . . . . 0.0 111.847 179.345 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.64 ' HB2' ' CE1' ' A' ' 24' ' ' TYR . . . -104.29 -171.83 2.0 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.895 179.861 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -120.54 -16.24 8.35 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 112.117 0.414 . . . . 0.0 112.117 -179.716 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 5.1 t -160.76 26.51 0.15 Allowed 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 111.902 0.334 . . . . 0.0 111.902 -179.784 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER 51.6 53.6 13.48 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-O 120.686 0.279 . . . . 0.0 111.06 179.583 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -70.41 58.88 1.91 Allowed 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.285 1.99 . . . . 0.0 110.338 178.606 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 36.3 t -130.12 133.3 46.55 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.474 -0.784 . . . . 0.0 111.024 -178.364 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 175.22 46.08 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.799 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.405 ' HB2' ' HD2' ' A' ' 53' ' ' PRO . 0.6 OUTLIER -127.96 164.17 38.73 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.707 -179.963 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . 0.405 ' HD2' ' HB2' ' A' ' 52' ' ' LYS . 11.2 Cg_endo -54.91 -162.97 0.01 OUTLIER 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.725 2.283 . . . . 0.0 112.268 -180.0 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.472 0.645 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.378 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 11.6 t . . . . . 0 CA--C 1.528 0.106 0 CA-C-O 120.801 0.334 . . . . 0.0 110.906 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 10.8 m 60.02 110.92 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.179 179.858 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.498 ' HB3' ' C ' ' A' ' 23' ' ' CYS . 46.9 t -100.29 35.27 2.13 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.422 179.599 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.833 ' CB ' HD13 ' A' ' 22' ' ' LEU . 52.9 p -60.79 80.25 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.117 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.73 -180.0 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.67 HG22 ' HG2' ' A' ' 64' ' ' LYS . 55.0 m 179.47 -33.24 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.364 -0.835 . . . . 0.0 109.384 -179.77 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . 0.837 ' HB2' HG22 ' A' ' 1' ' ' ILE . 0.8 OUTLIER 70.63 60.91 0.2 Allowed 'General case' 0 C--O 1.23 0.077 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.724 179.548 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.67 ' HG2' HG22 ' A' ' 62' ' ' THR . 5.5 ptmm? 178.82 39.71 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.647 179.267 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 2.3 m -103.01 17.71 23.41 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.04 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 6.6 p-10 -137.55 87.1 17.94 Favored Pre-proline 0 C--N 1.332 -0.186 0 CA-C-O 120.727 0.299 . . . . 0.0 111.481 -179.715 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -79.61 -42.32 0.17 Allowed 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.687 2.258 . . . . 0.0 112.041 179.71 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.419 ' HB3' ' HD2' ' A' ' 69' ' ' PRO . 53.6 m80 -133.28 162.03 60.17 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.534 179.863 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . 0.419 ' HD2' ' HB3' ' A' ' 68' ' ' HIS . 75.7 Cg_exo -49.39 -63.75 0.27 Allowed 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.414 2.076 . . . . 0.0 112.615 -179.859 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.462 ' HB2' ' HB3' ' A' ' 38' ' ' LYS . 0.0 OUTLIER -88.57 -159.19 0.53 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.834 -179.809 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 39.9 tt0 . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.803 179.918 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 192' ' ' CYS . . . . . 0.719 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.0 OUTLIER . . . . . 0 CA--C 1.5 -0.962 0 CA-C-O 122.015 0.912 . . . . 0.0 112.198 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 193' ' ' CYS . . . . . 0.719 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.0 OUTLIER 47.18 82.45 0.23 Allowed Pre-proline 0 N--CA 1.438 -1.037 0 CA-C-N 113.466 -1.697 . . . . 0.0 111.945 173.799 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 194' ' ' PRO . . . . . 0.408 ' HA ' ' O ' ' A' ' 8' ' ' THR . 50.0 Cg_exo -53.81 172.55 0.25 Allowed 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.677 2.251 . . . . 0.0 112.482 -179.899 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 195' ' ' ASP . . . . . 0.427 ' HB2' ' CD ' ' B' ' 197' ' ' PRO . 8.5 m-20 -71.6 -161.83 0.07 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.815 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 196' ' ' THR . . . . . 0.766 ' C ' ' H ' ' B' ' 198' ' ' TYR . 41.5 p -89.83 -5.17 0.1 Allowed Pre-proline 0 CA--C 1.532 0.256 0 N-CA-C 113.793 1.034 . . . . 0.0 113.793 -179.337 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 197' ' ' PRO . . . . . 0.669 ' CD ' ' N ' ' B' ' 196' ' ' THR . 22.8 Cg_exo -62.29 20.98 0.05 OUTLIER 'Trans proline' 0 C--N 1.357 1.014 0 CA-C-N 120.944 1.373 . . . . 0.0 110.282 177.327 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 198' ' ' TYR . . . . . 0.766 ' H ' ' C ' ' B' ' 196' ' ' THR . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.056 0 CA-C-N 114.713 -1.13 . . . . 0.0 110.931 -179.342 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 1' ' ' ILE . . . . . 0.463 HG23 ' HA ' ' A' ' 62' ' ' THR . 1.7 mp . . . . . 0 N--CA 1.486 1.341 0 CA-C-O 120.953 0.406 . . . . 0.0 111.139 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . 0.467 HG13 ' N ' ' A' ' 3' ' ' CYS . 0.3 OUTLIER -160.87 178.15 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.191 -179.914 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.467 ' N ' HG13 ' A' ' 2' ' ' VAL . 4.6 m -67.82 -159.7 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.252 179.79 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' HIS . . . . . 0.457 ' CE1' ' ND2' ' A' ' 66' ' ' ASN . 0.0 OUTLIER -156.84 142.05 17.28 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-O 121.263 0.554 . . . . 0.0 112.122 179.978 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 13.4 p -53.98 -31.03 49.48 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.428 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.56 -6.55 1.14 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.61 179.188 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.4 ' O ' ' HB ' ' A' ' 8' ' ' THR . . . -73.0 132.62 43.63 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.199 179.945 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.4 ' HB ' ' O ' ' A' ' 7' ' ' ALA . 89.4 m . . . . . 0 C--N 1.331 -0.206 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.077 179.862 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.48 ' HB2' ' HD3' ' A' ' 18' ' ' PRO . 38.6 Cg_exo . . . . . 0 CA--C 1.53 0.276 0 N-CA-C 112.83 0.281 . . . . 0.0 112.83 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.48 ' HD3' ' HB2' ' A' ' 17' ' ' PRO . 89.3 Cg_endo -81.46 -171.82 1.32 Allowed 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.499 2.133 . . . . 0.0 112.412 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -112.73 144.5 17.97 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.175 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 58.14 72.25 0.53 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.921 0.391 . . . . 0.0 110.65 -179.814 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -119.86 -7.34 10.0 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.647 -179.353 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.978 HD12 ' CB ' ' A' ' 48' ' ' CYS . 1.5 mt 61.88 88.33 0.09 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.53 0.205 . . . . 0.0 110.838 179.773 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.446 ' HA ' ' CA ' ' A' ' 44' ' ' CYS . 1.7 t -59.5 73.94 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.494 -179.794 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.471 ' CB ' ' HA ' ' A' ' 59' ' ' CYS . 0.0 OUTLIER -114.97 156.59 24.78 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.843 -179.069 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 2.8 ttt180 -144.7 -81.09 0.17 Allowed 'General case' 0 CA--C 1.53 0.208 0 CA-C-O 120.836 0.35 . . . . 0.0 111.559 179.146 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 2.8 mtmm -179.77 110.52 0.04 OUTLIER 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.318 -179.725 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -89.19 122.54 32.58 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.843 -179.586 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -87.58 -179.86 6.4 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.856 0.36 . . . . 0.0 110.986 179.966 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 8.4 m -158.93 -178.04 6.95 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.798 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -109.24 -75.75 0.62 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.842 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -127.37 -70.07 0.72 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.975 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 37.6 t80 -102.27 -29.34 11.74 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.848 179.821 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 62.23 85.62 0.12 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.786 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 11.4 p -98.97 -57.57 2.14 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.976 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 2.3 p -135.11 31.69 3.22 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.991 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 2.8 mtt85 -107.84 -81.41 0.56 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.872 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 49.83 39.37 32.06 Favored Glycine 0 C--N 1.331 0.271 0 C-N-CA 120.818 -0.706 . . . . 0.0 112.775 179.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.572 ' HA ' ' HG2' ' A' ' 70' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.306 0 CA-C-O 120.712 0.291 . . . . 0.0 111.068 -179.814 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . 0.432 ' N ' ' O ' ' A' ' 24' ' ' TYR . . . . . . . . 0 N--CA 1.45 -0.387 0 N-CA-C 112.509 -0.236 . . . . 0.0 112.509 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.483 ' HA ' ' O ' ' A' ' 22' ' ' LEU . 0.7 OUTLIER 59.25 129.86 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.197 0 N-CA-C 113.362 0.875 . . . . 0.0 113.362 178.528 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.416 ' O ' ' N ' ' A' ' 47' ' ' THR . . . -152.92 113.27 4.02 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.091 -0.959 . . . . 0.0 110.237 178.76 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.503 ' C ' HG22 ' A' ' 47' ' ' THR . . . -60.75 78.61 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.97 -179.316 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.676 HG23 ' H ' ' A' ' 48' ' ' CYS . 0.0 OUTLIER 167.71 -77.61 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.688 179.331 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.978 ' CB ' HD12 ' A' ' 22' ' ' LEU . 0.0 OUTLIER 47.41 63.1 10.75 Favored Pre-proline 0 C--O 1.233 0.209 0 CA-C-O 120.991 0.424 . . . . 0.0 111.944 179.353 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.443 ' HD3' ' N ' ' A' ' 48' ' ' CYS . 74.2 Cg_endo -94.84 11.45 1.62 Allowed 'Trans proline' 0 N--CA 1.451 -1.029 0 C-N-CA 123.371 2.714 . . . . 0.0 110.99 178.62 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 46.2 t -61.89 142.11 57.59 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 115.289 -0.869 . . . . 0.0 111.731 -179.241 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 6.9 mttm -164.94 54.1 0.12 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.178 179.718 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.469 ' CB ' ' HD2' ' A' ' 53' ' ' PRO . 0.0 OUTLIER -112.73 168.37 7.79 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.931 -179.525 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . 0.469 ' HD2' ' CB ' ' A' ' 52' ' ' LYS . 12.5 Cg_endo -55.81 -162.05 0.01 OUTLIER 'Trans proline' 0 C--N 1.348 0.536 0 C-N-CA 122.778 2.318 . . . . 0.0 112.375 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.47 0.541 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.177 -179.871 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.411 ' O ' ' HB2' ' A' ' 59' ' ' CYS . 60.1 p . . . . . 0 CA--C 1.53 0.175 0 CA-C-O 120.845 0.355 . . . . 0.0 110.498 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . 0.471 ' HA ' ' CB ' ' A' ' 24' ' ' TYR . 5.4 m 69.19 103.94 0.06 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.864 179.767 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.453 ' O ' ' HB3' ' A' ' 22' ' ' LEU . 0.0 OUTLIER -74.37 -160.39 0.1 Allowed 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.703 179.831 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.706 ' HB2' HD22 ' A' ' 22' ' ' LEU . 0.0 OUTLIER 167.72 137.69 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 120.958 0.409 . . . . 0.0 111.623 179.518 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.463 ' HA ' HG23 ' A' ' 1' ' ' ILE . 0.0 OUTLIER 35.09 -91.66 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 115.474 -0.784 . . . . 0.0 112.158 179.318 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . 0.41 ' O ' ' N ' ' A' ' 65' ' ' CYS . 9.3 p-10 -55.82 125.64 22.19 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.84 0.353 . . . . 0.0 111.257 -179.689 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 3.3 pttp -56.32 86.98 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.654 179.796 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . 0.41 ' N ' ' O ' ' A' ' 63' ' ' ASP . 0.1 OUTLIER -77.24 58.69 1.66 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.297 -179.641 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.566 ' N ' ' HD3' ' A' ' 67' ' ' PRO . 1.0 OUTLIER -167.06 55.87 0.34 Allowed Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.756 179.24 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . 0.566 ' HD3' ' N ' ' A' ' 66' ' ' ASN . 26.2 Cg_exo -62.03 -65.67 0.06 OUTLIER 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 122.516 2.144 . . . . 0.0 112.41 -179.782 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -110.85 158.32 36.06 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.757 -179.838 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 7.9 Cg_exo -71.09 -74.63 0.01 OUTLIER 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.643 2.229 . . . . 0.0 112.314 -179.691 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.577 ' HD2' ' N ' ' A' ' 70' ' ' LYS . 0.0 OUTLIER 177.41 -102.16 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 116.686 -0.234 . . . . 0.0 111.396 -179.969 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 37.3 tp60 . . . . . 0 C--O 1.231 0.086 0 CA-C-O 120.713 0.292 . . . . 0.0 111.216 -179.572 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 192' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.504 -0.811 0 CA-C-O 122.03 0.919 . . . . 0.0 112.347 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 193' ' ' CYS . . . . . 0.487 ' N ' ' HD3' ' B' ' 194' ' ' PRO . 0.6 OUTLIER 31.24 58.42 1.07 Allowed Pre-proline 0 N--CA 1.438 -1.049 0 CA-C-N 112.782 -2.008 . . . . 0.0 113.209 172.609 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 194' ' ' PRO . . . . . 0.487 ' HD3' ' N ' ' B' ' 193' ' ' CYS . 57.1 Cg_endo -90.53 -68.31 0.01 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.801 0 C-N-CA 122.779 2.319 . . . . 0.0 112.502 179.9 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 178.94 129.77 0.07 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.84 0.352 . . . . 0.0 110.801 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 196' ' ' THR . . . . . 0.676 ' N ' ' HD3' ' B' ' 197' ' ' PRO . 11.4 t -139.4 46.2 1.04 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.95 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 197' ' ' PRO . . . . . 0.676 ' HD3' ' N ' ' B' ' 196' ' ' THR . 5.7 Cg_exo -73.54 12.62 0.84 Allowed 'Trans proline' 0 C--N 1.35 0.639 0 C-N-CA 121.688 1.592 . . . . 0.0 108.699 175.963 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 198' ' ' TYR . . . . . 0.59 ' H ' ' C ' ' B' ' 196' ' ' THR . 8.2 t80 . . . . . 0 C--O 1.249 1.076 0 CA-C-N 113.963 -1.471 . . . . 0.0 111.273 -178.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 1' ' ' ILE . . . . . 0.758 HG23 ' O ' ' A' ' 62' ' ' THR . 29.0 mm . . . . . 0 N--CA 1.486 1.369 0 CA-C-O 120.729 0.299 . . . . 0.0 111.07 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . 0.565 HG22 ' H ' ' A' ' 3' ' ' CYS . 3.6 p -172.37 170.69 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.002 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.565 ' H ' HG22 ' A' ' 2' ' ' VAL . 1.4 p -113.3 -162.14 0.79 Allowed 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 116.649 -0.25 . . . . 0.0 111.112 -179.521 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' HIS . . . . . 0.48 ' NE2' ' HB2' ' A' ' 66' ' ' ASN . 1.6 p80 -146.3 -175.96 4.98 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.874 0.369 . . . . 0.0 111.089 -179.851 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -97.9 80.97 2.8 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.69 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.532 HG21 ' O ' ' A' ' 67' ' ' PRO . 96.7 m -89.77 -3.68 58.04 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.826 179.705 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.493 ' HB1' ' NH1' ' A' ' 25' ' ' ARG . . . -79.4 131.66 36.16 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.738 0.304 . . . . 0.0 110.828 179.838 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 5.1 p . . . . . 0 C--N 1.328 -0.332 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.696 -179.647 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.579 ' N ' ' HD2' ' A' ' 18' ' ' PRO . 6.8 Cg_endo . . . . . 0 CA--C 1.535 0.532 0 N-CA-C 113.843 0.67 . . . . 0.0 113.843 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.579 ' HD2' ' N ' ' A' ' 17' ' ' PRO . 12.3 Cg_endo -55.83 -80.34 0.02 OUTLIER 'Trans proline' 0 C--N 1.349 0.582 0 C-N-CA 122.186 1.924 . . . . 0.0 112.733 -179.162 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -151.8 -148.31 4.8 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.49 -0.862 . . . . 0.0 112.65 -179.789 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 58.36 -179.39 0.07 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.798 0.332 . . . . 0.0 110.663 -179.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.609 ' H ' HD12 ' A' ' 22' ' ' LEU . 14.0 p30 -177.25 39.29 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.898 -179.988 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.738 HD22 ' SG ' ' A' ' 48' ' ' CYS . 0.4 OUTLIER -146.72 81.67 1.56 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.758 179.935 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.837 ' HA ' ' H ' ' A' ' 44' ' ' CYS . 6.5 m -58.02 120.66 8.95 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.994 -179.698 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.897 ' CD1' ' HB2' ' A' ' 45' ' ' ALA . 0.4 OUTLIER -133.47 -32.66 1.14 Allowed 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 113.032 0.753 . . . . 0.0 113.032 -178.303 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.493 ' NH1' ' HB1' ' A' ' 7' ' ' ALA . 1.6 ttm180 37.1 -117.55 0.15 Allowed 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 112.677 0.621 . . . . 0.0 112.677 -178.504 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -156.41 126.49 6.48 Favored 'General case' 0 C--N 1.344 0.332 0 C-N-CA 122.351 0.26 . . . . 0.0 110.574 -179.513 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 3.0 tmm? -104.92 159.33 15.89 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.606 0.241 . . . . 0.0 110.881 -179.688 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' TRP . . . . . 0.415 ' O ' ' HA2' ' A' ' 37' ' ' GLY . 3.2 t-105 -130.21 143.71 50.94 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.904 0.383 . . . . 0.0 111.286 179.84 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . 0.516 ' HB3' ' N ' ' A' ' 37' ' ' GLY . 0.0 OUTLIER 61.48 131.98 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.853 -179.9 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 3.7 t0 -178.76 -177.94 0.54 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.747 179.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . 64.28 -80.8 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.287 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -120.54 56.58 0.98 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.838 0.351 . . . . 0.0 111.033 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 46.4 t -127.04 83.63 2.19 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.909 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 37.2 p -48.59 -43.11 35.73 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-O 120.948 0.404 . . . . 0.0 110.697 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.445 ' O ' ' C ' ' A' ' 36' ' ' ARG . 0.3 OUTLIER -93.27 -151.01 0.29 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.921 179.335 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.475 ' HB3' ' CB ' ' A' ' 29' ' ' CYS . 0.3 OUTLIER 28.6 -139.97 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 122.593 0.357 . . . . 0.0 111.62 179.178 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.516 ' N ' ' HB3' ' A' ' 29' ' ' CYS . . . 65.35 9.23 41.83 Favored Glycine 0 C--N 1.338 0.66 0 C-N-CA 120.041 -1.076 . . . . 0.0 113.17 179.839 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.428 ' HB3' ' HB3' ' A' ' 69' ' ' PRO . 0.0 OUTLIER . . . . . 0 N--CA 1.463 0.204 0 CA-C-N 117.071 0.436 . . . . 0.0 110.991 179.736 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . 0.425 ' N ' ' HB2' ' A' ' 25' ' ' ARG . . . . . . . . 0 N--CA 1.449 -0.496 0 N-CA-C 111.387 -0.685 . . . . 0.0 111.387 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.837 ' H ' ' HA ' ' A' ' 23' ' ' CYS . 70.8 m 65.4 140.84 0.02 OUTLIER 'General case' 0 N--CA 1.461 0.115 0 CA-C-O 120.977 0.417 . . . . 0.0 111.685 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.897 ' HB2' ' CD1' ' A' ' 24' ' ' TYR . . . -117.19 -82.47 0.63 Allowed 'General case' 0 C--O 1.232 0.143 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.214 179.779 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.548 ' HB2' ' O ' ' A' ' 45' ' ' ALA . . . 169.22 -39.37 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.897 0.38 . . . . 0.0 110.963 -179.861 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.7 m -162.71 -7.77 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 116.078 -0.51 . . . . 0.0 112.018 -179.417 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.738 ' SG ' HD22 ' A' ' 22' ' ' LEU . 1.5 m 64.22 59.35 1.64 Allowed Pre-proline 0 C--N 1.332 -0.186 0 CA-C-O 120.539 0.209 . . . . 0.0 111.234 179.842 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.51 ' HD3' ' N ' ' A' ' 48' ' ' CYS . 2.9 Cg_endo -79.99 -2.02 11.8 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 122.675 2.25 . . . . 0.0 111.473 178.906 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 34.7 t -53.91 144.78 17.88 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.727 -0.669 . . . . 0.0 111.575 -179.857 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 7.5 pttt 179.99 75.22 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.767 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.42 ' HB2' ' HD2' ' A' ' 53' ' ' PRO . 0.6 OUTLIER -150.49 162.68 26.7 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.837 -179.864 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . 0.42 ' HD2' ' HB2' ' A' ' 52' ' ' LYS . 9.8 Cg_endo -50.81 -72.6 0.04 OUTLIER 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.741 2.294 . . . . 0.0 112.257 179.887 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.47 0.564 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.953 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.406 ' OG1' ' N ' ' A' ' 59' ' ' CYS . 0.0 OUTLIER . . . . . 0 CA--C 1.533 0.324 0 N-CA-C 110.562 -0.162 . . . . 0.0 110.562 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . 0.481 ' HA ' ' HB3' ' A' ' 24' ' ' TYR . 0.8 OUTLIER 167.45 172.41 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 120.778 0.323 . . . . 0.0 110.648 179.772 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.536 ' HB2' ' O ' ' A' ' 23' ' ' CYS . 9.7 t -125.05 -86.49 0.63 Allowed 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.117 -179.603 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.453 ' O ' HG23 ' A' ' 62' ' ' THR . 19.6 p 53.59 -158.23 0.16 Allowed 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 120.603 0.24 . . . . 0.0 111.223 179.663 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.758 ' O ' HG23 ' A' ' 1' ' ' ILE . 0.1 OUTLIER 46.83 -90.46 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.565 -179.966 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -127.03 -178.74 4.53 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.817 0.342 . . . . 0.0 111.099 -179.795 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.9 ptpp? -68.22 73.53 0.21 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.854 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 18.0 p -57.28 -31.0 65.16 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.263 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.48 ' HB2' ' NE2' ' A' ' 4' ' ' HIS . 1.5 m-80 -31.16 92.82 0.05 OUTLIER Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 115.656 -0.702 . . . . 0.0 112.477 -178.642 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . 0.532 ' O ' HG21 ' A' ' 6' ' ' THR . 71.7 Cg_endo -90.04 -170.93 0.44 Allowed 'Trans proline' 0 N--CA 1.457 -0.63 0 C-N-CA 123.029 2.486 . . . . 0.0 112.56 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.474 ' HB3' ' HD2' ' A' ' 69' ' ' PRO . 27.3 m80 -110.52 166.01 11.59 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.366 179.707 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . 0.474 ' HD2' ' HB3' ' A' ' 68' ' ' HIS . 83.0 Cg_exo -49.13 133.1 28.99 Favored 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 122.393 2.062 . . . . 0.0 112.013 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -46.73 -41.13 14.66 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.473 -179.463 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.682 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 192' ' ' CYS . . . . . 0.71 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.0 OUTLIER . . . . . 0 CA--C 1.499 -0.993 0 CA-C-O 121.927 0.87 . . . . 0.0 111.756 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 193' ' ' CYS . . . . . 0.71 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.0 OUTLIER 46.51 82.13 0.24 Allowed Pre-proline 0 N--CA 1.44 -0.952 0 CA-C-N 113.598 -1.637 . . . . 0.0 112.043 173.602 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 194' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -83.54 52.5 3.86 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.899 2.399 . . . . 0.0 112.644 -179.763 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -178.5 110.72 0.06 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.883 0.373 . . . . 0.0 111.4 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 196' ' ' THR . . . . . 0.58 ' C ' ' H ' ' B' ' 198' ' ' TYR . 4.9 t -152.75 41.9 0.2 Allowed Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.648 179.698 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 197' ' ' PRO . . . . . 0.519 ' CD ' ' N ' ' B' ' 196' ' ' THR . 74.4 Cg_endo -72.77 11.47 0.85 Allowed 'Trans proline' 0 C--N 1.348 0.526 0 C-N-CA 121.607 1.538 . . . . 0.0 108.951 176.277 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 198' ' ' TYR . . . . . 0.58 ' H ' ' C ' ' B' ' 196' ' ' THR . 0.9 OUTLIER . . . . . 0 C--O 1.248 1.019 0 CA-C-N 113.9 -1.5 . . . . 0.0 111.153 -179.088 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 1' ' ' ILE . . . . . 0.408 HD12 ' N ' ' A' ' 1' ' ' ILE . 4.5 mp . . . . . 0 N--CA 1.486 1.363 0 CA-C-O 120.704 0.288 . . . . 0.0 111.055 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . 0.638 HG12 ' H ' ' A' ' 4' ' ' HIS . 53.4 t 62.53 144.47 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.807 -179.925 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 14.5 p -117.48 24.67 10.95 Favored 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 113.34 0.866 . . . . 0.0 113.34 -178.079 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' HIS . . . . . 0.638 ' H ' HG12 ' A' ' 2' ' ' VAL . 0.0 OUTLIER 68.07 162.7 0.2 Allowed 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 118.185 0.448 . . . . 0.0 110.073 -179.757 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.3 p -78.82 -161.96 0.34 Allowed 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 110.361 -0.237 . . . . 0.0 110.361 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 16.9 p -74.98 53.7 0.62 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.769 0.319 . . . . 0.0 111.106 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 48.24 -148.15 0.22 Allowed 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 116.484 -0.326 . . . . 0.0 110.897 179.894 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.446 HG23 ' HD2' ' B' ' 194' ' ' PRO . 0.2 OUTLIER . . . . . 0 N--CA 1.461 0.099 0 CA-C-O 121.14 0.495 . . . . 0.0 111.324 179.585 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo . . . . . 0 C--O 1.231 0.152 0 N-CA-C 112.725 0.241 . . . . 0.0 112.725 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_exo -69.66 -52.81 0.31 Allowed 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.557 2.171 . . . . 0.0 111.399 179.376 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -112.82 -34.5 1.85 Allowed Glycine 0 N--CA 1.45 -0.377 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.999 179.54 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.445 ' HB2' HD12 ' A' ' 22' ' ' LEU . 0.0 OUTLIER -73.12 -175.6 1.88 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.786 0.327 . . . . 0.0 110.792 179.941 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 21.3 m-20 -123.78 -0.4 8.54 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.647 -179.885 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.591 HD22 ' HB2' ' A' ' 59' ' ' CYS . 0.1 OUTLIER -103.81 177.13 4.93 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.773 0.321 . . . . 0.0 110.917 -179.94 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.494 ' HA ' ' HA ' ' A' ' 44' ' ' CYS . 35.6 t -157.88 8.33 0.15 Allowed 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 -179.384 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.631 ' CE1' ' HB3' ' A' ' 45' ' ' ALA . 3.2 m-85 52.18 173.09 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 120.643 0.258 . . . . 0.0 111.001 -179.723 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.477 ' HB2' ' O ' ' A' ' 24' ' ' TYR . 0.6 OUTLIER 161.35 104.28 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.907 179.675 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.0 -179.65 0.05 Allowed 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 178.932 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . 0.474 ' O ' ' O ' ' A' ' 28' ' ' TRP . 0.0 OUTLIER -146.04 44.75 1.25 Allowed 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.114 -0.635 . . . . 0.0 112.405 -179.522 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' TRP . . . . . 0.63 ' HB2' ' HA2' ' A' ' 37' ' ' GLY . 14.3 p-90 45.65 172.3 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 113.482 0.919 . . . . 0.0 113.482 178.28 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . 0.402 ' HB2' ' HE3' ' A' ' 28' ' ' TRP . 0.5 OUTLIER 37.1 -157.72 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 114.855 -1.066 . . . . 0.0 111.996 179.735 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 19.7 t0 -165.95 92.95 0.52 Allowed 'General case' 0 C--N 1.334 -0.096 0 CA-C-O 120.943 0.402 . . . . 0.0 111.206 -179.874 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . 62.79 140.13 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.709 179.578 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 17.6 t80 45.8 84.07 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 115.934 -0.576 . . . . 0.0 111.488 179.751 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 85.4 m -153.19 133.0 13.17 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.092 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -126.06 -44.21 1.77 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.752 179.888 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 1.2 m -93.13 -51.76 4.88 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.815 179.877 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 5.1 mpt_? -57.65 -170.15 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.728 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.63 ' HA2' ' HB2' ' A' ' 28' ' ' TRP . . . 105.07 -133.95 11.81 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.554 -0.831 . . . . 0.0 113.146 179.666 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.51 ' N ' ' HD3' ' A' ' 38' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.334 -0.085 0 CA-C-O 121.054 0.454 . . . . 0.0 110.914 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . 0.454 ' CA ' ' HB2' ' A' ' 24' ' ' TYR . . . . . . . . 0 CA--C 1.518 0.233 0 N-CA-C 112.827 -0.109 . . . . 0.0 112.827 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.494 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 0.9 OUTLIER 66.88 90.18 0.1 Allowed 'General case' 0 C--O 1.232 0.139 0 CA-C-O 121.034 0.445 . . . . 0.0 110.862 -179.783 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.631 ' HB3' ' CE1' ' A' ' 24' ' ' TYR . . . -128.08 -165.04 1.44 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.897 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -141.51 55.52 1.52 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.953 0.406 . . . . 0.0 110.977 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.52 HG23 ' HD2' ' A' ' 49' ' ' PRO . 4.0 t -175.12 137.66 0.41 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.631 -179.823 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.738 ' N ' ' HD3' ' A' ' 49' ' ' PRO . 56.5 m -118.54 30.43 0.15 Allowed Pre-proline 0 CA--C 1.537 0.479 0 N-CA-C 113.3 0.852 . . . . 0.0 113.3 -179.664 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.738 ' HD3' ' N ' ' A' ' 48' ' ' CYS . 36.3 Cg_exo -59.05 -16.57 33.59 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 121.703 1.602 . . . . 0.0 111.971 179.068 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 6.6 t -38.17 131.71 1.11 Allowed 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.78 -179.614 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 23.0 mtmm -166.59 -38.98 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.092 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.51 ' H ' ' HD2' ' A' ' 53' ' ' PRO . 0.0 OUTLIER -117.81 -67.24 0.02 OUTLIER Pre-proline 0 CA--C 1.533 0.299 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.785 -179.416 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . 0.51 ' HD2' ' H ' ' A' ' 52' ' ' LYS . 21.8 Cg_endo -60.45 -85.43 0.01 OUTLIER 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.137 1.891 . . . . 0.0 112.534 -179.43 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.47 0.536 0 CA-C-O 120.9 0.381 . . . . 0.0 110.673 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.23 0.072 0 CA-C-O 120.746 0.308 . . . . 0.0 110.693 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . 0.591 ' HB2' HD22 ' A' ' 22' ' ' LEU . 9.1 p -46.39 -30.17 2.01 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.361 -0.382 . . . . 0.0 111.064 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.501 ' O ' ' CB ' ' A' ' 61' ' ' SER . 0.0 OUTLIER 74.16 172.7 0.28 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.748 179.939 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.501 ' CB ' ' O ' ' A' ' 60' ' ' CYS . 2.8 p 154.06 68.3 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.557 -179.814 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -161.78 173.44 14.61 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.041 -179.899 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -68.85 -42.2 77.43 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.811 179.901 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.437 ' HD2' ' CD2' ' A' ' 4' ' ' HIS . 40.5 mmtm -116.76 84.31 2.12 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.719 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -73.19 -27.09 61.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.178 -179.883 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -128.23 74.09 79.58 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.072 -179.883 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 15.3 Cg_exo -68.57 67.57 1.13 Allowed 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.803 2.335 . . . . 0.0 112.335 -179.817 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 2.5 m-70 61.7 153.94 0.11 Allowed Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.032 179.774 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -59.18 -162.22 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.675 2.25 . . . . 0.0 112.19 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.539 ' O ' ' C ' ' A' ' 71' ' ' GLN . 0.0 OUTLIER -121.91 -33.19 3.6 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.491 179.833 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.539 ' C ' ' O ' ' A' ' 70' ' ' LYS . 1.8 tt0 . . . . . 0 N--CA 1.473 0.72 0 N-CA-C 112.785 0.661 . . . . 0.0 112.785 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 192' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.502 -0.899 0 CA-C-O 122.23 1.014 . . . . 0.0 111.557 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 193' ' ' CYS . . . . . 0.583 ' N ' ' CD ' ' B' ' 194' ' ' PRO . 0.5 OUTLIER -144.12 35.29 0.19 Allowed Pre-proline 0 N--CA 1.43 -1.475 0 CA-C-N 113.025 -1.898 . . . . 0.0 112.826 -172.851 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 194' ' ' PRO . . . . . 0.583 ' CD ' ' N ' ' B' ' 193' ' ' CYS . 92.6 Cg_endo -79.89 -34.31 0.96 Allowed 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 122.312 2.008 . . . . 0.0 112.454 179.821 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 195' ' ' ASP . . . . . 0.416 ' C ' ' HD3' ' B' ' 197' ' ' PRO . 36.9 t70 -112.64 39.8 2.41 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.402 -179.531 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 196' ' ' THR . . . . . 0.753 ' N ' ' HD3' ' B' ' 197' ' ' PRO . 15.1 t -112.4 21.78 0.08 OUTLIER Pre-proline 0 CA--C 1.531 0.245 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 179.914 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 197' ' ' PRO . . . . . 0.753 ' HD3' ' N ' ' B' ' 196' ' ' THR . 8.0 Cg_exo -67.36 16.4 0.12 Allowed 'Trans proline' 0 C--N 1.357 1.025 0 CA-C-N 120.427 1.188 . . . . 0.0 109.593 176.304 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 198' ' ' TYR . . . . . 0.681 ' H ' ' C ' ' B' ' 196' ' ' THR . 38.4 t80 . . . . . 0 C--O 1.25 1.106 0 CA-C-N 114.554 -1.203 . . . . 0.0 111.23 -178.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 1' ' ' ILE . . . . . 0.443 HG22 ' HG2' ' A' ' 64' ' ' LYS . 6.8 mm . . . . . 0 N--CA 1.487 1.381 0 CA-C-O 120.822 0.344 . . . . 0.0 111.009 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . 0.534 ' C ' ' HG3' ' A' ' 64' ' ' LYS . 95.8 t -129.35 138.44 54.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.565 179.602 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.51 ' N ' ' HG3' ' A' ' 64' ' ' LYS . 1.3 m -84.11 -174.56 5.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.507 -178.891 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' HIS . . . . . 0.453 ' CG ' ' ND2' ' A' ' 66' ' ' ASN . 0.0 OUTLIER -149.05 127.08 11.95 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.236 179.648 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -45.99 -50.19 15.18 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.151 -179.82 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.563 ' O ' HG22 ' A' ' 6' ' ' THR . 21.8 m 47.34 28.1 1.01 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.92 179.471 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.39 -70.1 0.19 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.057 0.456 . . . . 0.0 110.535 179.546 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 1.1 p . . . . . 0 C--N 1.328 -0.355 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.133 179.238 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo . . . . . 0 CA--C 1.531 0.337 0 N-CA-C 112.83 0.281 . . . . 0.0 112.83 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -59.16 -60.54 0.32 Allowed 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.841 2.36 . . . . 0.0 112.826 -179.596 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -58.84 -141.26 0.01 OUTLIER Glycine 0 CA--C 1.518 0.261 0 CA-C-N 116.004 -0.544 . . . . 0.0 113.116 -179.262 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -57.11 -163.74 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.751 0.31 . . . . 0.0 111.234 -179.672 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 4.8 m120 74.23 69.54 0.1 Allowed 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.764 -179.856 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.43 HD13 ' HZ3' ' A' ' 64' ' ' LYS . 3.4 mm? -86.41 178.85 6.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.961 -179.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.539 ' HA ' ' HA ' ' A' ' 44' ' ' CYS . 0.8 OUTLIER -55.01 171.44 0.14 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.098 0.475 . . . . 0.0 111.855 -179.266 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.85 ' CD1' ' HB2' ' A' ' 45' ' ' ALA . 0.0 OUTLIER -109.61 -162.55 0.81 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.731 -179.655 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -165.88 69.2 0.12 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.962 179.695 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.467 ' O ' ' HG3' ' A' ' 26' ' ' LYS . 11.6 tptm -95.39 62.44 2.44 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.814 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . 0.452 ' HE1' ' HD3' ' A' ' 70' ' ' LYS . 6.4 ttt -97.09 90.59 5.21 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 10.7 t-105 -39.78 -86.5 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 -178.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 10.4 t 72.76 154.01 0.14 Allowed 'General case' 0 N--CA 1.462 0.172 0 CA-C-O 120.691 0.282 . . . . 0.0 110.513 -179.554 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -121.29 111.61 17.58 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.869 0.366 . . . . 0.0 111.367 -179.596 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . 57.15 -86.39 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.348 179.683 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 6.3 p90 -108.15 131.31 54.77 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.896 0.379 . . . . 0.0 110.805 -179.845 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -86.44 -166.23 1.49 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.904 -179.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 76.42 99.37 0.07 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.354 -179.551 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 4.7 p 60.83 32.12 20.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.539 -179.51 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 9.1 tpt85 -96.1 -84.99 0.34 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.214 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -123.4 -14.63 3.93 Favored Glycine 0 C--N 1.334 0.459 0 C-N-CA 120.388 -0.91 . . . . 0.0 113.56 -179.504 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.475 ' HA ' ' HG3' ' A' ' 70' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.331 -0.226 0 CA-C-N 117.188 0.494 . . . . 0.0 110.434 -179.621 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.672 0 CA-C-O 120.037 -0.313 . . . . 0.0 113.584 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.539 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 1.3 m 61.06 150.42 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 117.379 0.589 . . . . 0.0 111.222 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.85 ' HB2' ' CD1' ' A' ' 24' ' ' TYR . . . -135.2 -167.74 2.06 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.481 -179.445 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -114.78 -28.33 7.12 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.899 179.527 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.723 HG23 ' HD3' ' A' ' 49' ' ' PRO . 1.8 t -158.09 -120.49 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.464 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.423 ' N ' ' OG1' ' A' ' 47' ' ' THR . 2.1 t -178.01 65.19 0.19 Allowed Pre-proline 0 C--O 1.231 0.119 0 CA-C-O 120.812 0.339 . . . . 0.0 111.103 -179.921 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.723 ' HD3' HG23 ' A' ' 47' ' ' THR . 96.4 Cg_endo -78.78 14.33 1.71 Allowed 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.575 2.184 . . . . 0.0 111.544 178.811 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 31.5 t -61.0 135.71 57.87 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.584 -0.734 . . . . 0.0 111.415 -179.608 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 6.4 pttt 171.15 44.15 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.687 179.72 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.56 165.63 17.16 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.875 -179.87 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_exo -60.03 -68.08 0.05 OUTLIER 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 122.562 2.175 . . . . 0.0 112.339 -179.831 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.468 0.447 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.53 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 71.9 p . . . . . 0 N--CA 1.468 0.447 0 N-CA-C 112.512 0.56 . . . . 0.0 112.512 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 2.6 p -51.96 -173.79 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.919 -179.509 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.402 ' HB3' ' CB ' ' A' ' 23' ' ' CYS . 0.6 OUTLIER -163.56 70.08 0.22 Allowed 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.616 179.992 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.564 ' O ' ' HB ' ' A' ' 62' ' ' THR . 9.7 p -88.21 128.68 35.46 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.6 -179.492 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.564 ' HB ' ' O ' ' A' ' 61' ' ' SER . 6.0 t 144.41 -146.13 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 108.458 -0.942 . . . . 0.0 108.458 -179.758 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . 0.425 ' N ' ' OG1' ' A' ' 62' ' ' THR . 19.9 m-20 -74.38 55.39 0.62 Allowed 'General case' 0 C--N 1.332 -0.196 0 N-CA-C 109.684 -0.488 . . . . 0.0 109.684 178.581 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.534 ' HG3' ' C ' ' A' ' 2' ' ' VAL . 1.7 mmtp 36.05 45.46 0.31 Allowed 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 115.387 -0.824 . . . . 0.0 112.479 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . 0.471 ' HB2' ' HD3' ' A' ' 67' ' ' PRO . 0.0 OUTLIER 50.19 -82.63 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 115.481 -0.781 . . . . 0.0 112.301 178.651 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.475 ' N ' ' HD3' ' A' ' 67' ' ' PRO . 1.0 OUTLIER 52.98 57.61 14.56 Favored Pre-proline 0 CA--C 1.532 0.283 0 CA-C-O 120.752 0.311 . . . . 0.0 111.178 -179.589 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . 0.475 ' HD3' ' N ' ' A' ' 66' ' ' ASN . 63.8 Cg_endo -92.38 18.3 1.11 Allowed 'Trans proline' 0 N--CA 1.458 -0.616 0 C-N-CA 122.98 2.453 . . . . 0.0 113.142 -179.552 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.413 ' HB3' ' HD2' ' A' ' 69' ' ' PRO . 79.7 m80 60.83 158.63 0.11 Allowed Pre-proline 0 C--N 1.33 -0.243 0 CA-C-N 116.698 -0.228 . . . . 0.0 110.65 -179.793 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . 0.446 ' O ' ' N ' ' A' ' 71' ' ' GLN . 58.8 Cg_endo -71.82 64.12 3.18 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.424 2.082 . . . . 0.0 112.506 -179.706 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.475 ' HG3' ' HA ' ' A' ' 38' ' ' LYS . 2.4 mmmm 50.67 -87.66 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.174 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.446 ' N ' ' O ' ' A' ' 69' ' ' PRO . 8.2 tp-100 . . . . . 0 CA--C 1.529 0.173 0 CA-C-N 116.641 -0.254 . . . . 0.0 111.682 179.409 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 192' ' ' CYS . . . . . 0.701 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.5 OUTLIER . . . . . 0 CA--C 1.497 -1.059 0 CA-C-O 122.045 0.926 . . . . 0.0 111.473 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 193' ' ' CYS . . . . . 0.701 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.0 OUTLIER -155.3 166.7 15.64 Favored Pre-proline 0 N--CA 1.435 -1.203 0 CA-C-N 113.44 -1.709 . . . . 0.0 111.574 -173.647 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 194' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -74.23 -162.41 0.14 Allowed 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.613 2.208 . . . . 0.0 112.365 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -133.64 58.52 1.77 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.249 179.622 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 196' ' ' THR . . . . . 0.733 ' N ' ' HD3' ' B' ' 197' ' ' PRO . 16.0 p -101.82 12.13 0.06 OUTLIER Pre-proline 0 CA--C 1.534 0.347 0 N-CA-C 113.893 1.072 . . . . 0.0 113.893 -179.508 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 197' ' ' PRO . . . . . 0.733 ' HD3' ' N ' ' B' ' 196' ' ' THR . 13.5 Cg_exo -66.47 22.78 0.1 OUTLIER 'Trans proline' 0 C--N 1.359 1.116 0 CA-C-N 121.014 1.398 . . . . 0.0 109.934 176.85 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 198' ' ' TYR . . . . . 0.721 ' H ' ' C ' ' B' ' 196' ' ' THR . 35.4 t80 . . . . . 0 C--O 1.248 1.011 0 CA-C-N 114.584 -1.189 . . . . 0.0 111.281 -178.797 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 1' ' ' ILE . . . . . 0.42 ' CG1' ' HA ' ' A' ' 63' ' ' ASP . 1.0 OUTLIER . . . . . 0 N--CA 1.487 1.38 0 CA-C-O 120.396 0.141 . . . . 0.0 110.924 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . 0.507 HG12 ' N ' ' A' ' 3' ' ' CYS . 84.1 t -42.49 159.7 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.462 0.171 0 CA-C-O 120.528 0.204 . . . . 0.0 111.29 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.507 ' N ' HG12 ' A' ' 2' ' ' VAL . 49.7 t -158.06 41.89 0.28 Allowed 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 112.582 0.586 . . . . 0.0 112.582 -178.716 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' HIS . . . . . 0.438 ' CE1' ' HB2' ' A' ' 64' ' ' LYS . 0.1 OUTLIER 49.95 -176.91 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.82 0.343 . . . . 0.0 111.687 179.105 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 17.1 p -63.55 -132.05 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.7 179.782 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 6.4 p -96.15 30.84 2.33 Favored 'General case' 0 CA--C 1.528 0.121 0 CA-C-O 120.812 0.339 . . . . 0.0 111.106 -179.857 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 60.93 52.75 4.02 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.911 0.386 . . . . 0.0 111.098 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 25.5 p . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.721 179.913 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.453 ' N ' ' CD ' ' A' ' 18' ' ' PRO . 37.1 Cg_exo . . . . . 0 CA--C 1.53 0.282 0 CA-C-O 120.481 0.117 . . . . 0.0 112.378 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.453 ' CD ' ' N ' ' A' ' 17' ' ' PRO . 77.2 Cg_endo -87.16 174.22 5.39 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 122.742 2.295 . . . . 0.0 112.471 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 52.98 -167.06 1.19 Allowed Glycine 0 C--N 1.331 0.276 0 C-N-CA 120.913 -0.66 . . . . 0.0 112.855 179.795 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.62 ' HB2' ' HB2' ' A' ' 46' ' ' ALA . 0.3 OUTLIER -100.21 -153.81 0.46 Allowed 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 110.449 -0.204 . . . . 0.0 110.449 179.813 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.436 ' C ' HD22 ' A' ' 22' ' ' LEU . 28.9 p-10 -106.19 64.8 0.68 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.748 0.308 . . . . 0.0 111.541 -179.574 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.557 HD13 ' CB ' ' A' ' 61' ' ' SER . 4.1 mm? -112.89 7.57 18.35 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.295 179.541 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.708 ' HB3' ' HB3' ' A' ' 60' ' ' CYS . 40.0 t 24.19 43.69 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.477 0.711 . . . . 0.0 112.623 179.867 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.617 ' HB3' ' HA3' ' A' ' 43' ' ' GLY . 0.0 OUTLIER -36.32 91.52 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.87 178.733 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.465 ' N ' ' O ' ' A' ' 23' ' ' CYS . 2.0 ptt180 -97.18 98.62 10.18 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.883 0.373 . . . . 0.0 111.28 -179.242 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.53 177.4 2.45 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.088 -0.505 . . . . 0.0 109.713 179.195 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 18.1 ttp -176.77 164.47 2.41 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.806 0.336 . . . . 0.0 110.703 179.812 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 2.4 t90 -105.74 -137.15 0.36 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.279 179.828 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 71.15 -162.73 0.14 Allowed 'General case' 0 CA--C 1.529 0.165 0 CA-C-O 120.682 0.277 . . . . 0.0 110.558 -179.912 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.538 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 0.1 OUTLIER 173.72 37.36 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.96 179.875 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.538 ' HB3' ' O ' ' A' ' 30' ' ' ASP . . . 76.29 -54.52 0.6 Allowed 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.498 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -46.24 -28.71 1.35 Allowed 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 111.815 0.302 . . . . 0.0 111.815 -179.591 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -83.84 133.81 34.73 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.87 0.367 . . . . 0.0 110.62 179.784 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 74.2 p -64.42 76.93 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.313 -179.638 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 29.6 t 49.15 59.9 4.13 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.287 179.695 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.406 ' C ' ' HD3' ' A' ' 38' ' ' LYS . 4.9 mmm-85 -101.98 -107.53 0.24 Allowed 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.686 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.447 ' O ' ' HG2' ' A' ' 38' ' ' LYS . . . 76.22 -95.38 1.06 Allowed Glycine 0 C--N 1.335 0.482 0 C-N-CA 120.607 -0.806 . . . . 0.0 113.115 179.745 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.447 ' HG2' ' O ' ' A' ' 37' ' ' GLY . 0.0 OUTLIER . . . . . 0 N--CA 1.468 0.428 0 N-CA-C 112.615 0.598 . . . . 0.0 112.615 -179.574 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . 0.617 ' HA3' ' HB3' ' A' ' 24' ' ' TYR . . . . . . . . 0 N--CA 1.449 -0.456 0 CA-C-O 120.465 -0.075 . . . . 0.0 113.259 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.515 ' H ' ' N ' ' A' ' 24' ' ' TYR . 0.5 OUTLIER 55.44 79.34 0.16 Allowed 'General case' 0 CA--C 1.531 0.221 0 CA-C-O 120.764 0.316 . . . . 0.0 110.684 -179.29 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.436 ' HB3' ' CD1' ' A' ' 24' ' ' TYR . . . -96.52 -160.7 0.81 Allowed 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.492 -179.51 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.62 ' HB2' ' HB2' ' A' ' 20' ' ' GLU . . . -167.28 50.41 0.06 Allowed 'General case' 0 C--N 1.333 -0.115 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.452 -179.705 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.79 HG23 ' HD3' ' A' ' 49' ' ' PRO . 0.0 OUTLIER 178.41 -33.2 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.137 179.871 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.604 ' N ' ' HD3' ' A' ' 49' ' ' PRO . 85.5 m 68.66 34.32 0.1 Allowed Pre-proline 0 CA--C 1.534 0.341 0 N-CA-C 113.519 0.933 . . . . 0.0 113.519 179.135 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.79 ' HD3' HG23 ' A' ' 47' ' ' THR . 44.1 Cg_endo -88.88 13.97 2.37 Favored 'Trans proline' 0 C--N 1.35 0.608 0 C-N-CA 122.08 1.853 . . . . 0.0 110.894 178.106 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.493 ' O ' ' HB2' ' A' ' 51' ' ' LYS . 0.3 OUTLIER -97.05 42.33 1.09 Allowed 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 115.247 -0.888 . . . . 0.0 111.547 -178.726 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.493 ' HB2' ' O ' ' A' ' 50' ' ' SER . 12.5 mttt 74.56 162.53 0.26 Allowed 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.667 -179.638 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.584 ' HB2' ' CD ' ' A' ' 53' ' ' PRO . 0.1 OUTLIER -128.72 -70.51 0.02 OUTLIER Pre-proline 0 CA--C 1.534 0.363 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.891 -179.602 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . 0.584 ' CD ' ' HB2' ' A' ' 52' ' ' LYS . 36.8 Cg_endo -66.67 -61.94 0.08 OUTLIER 'Trans proline' 0 C--N 1.352 0.715 0 C-N-CA 121.987 1.791 . . . . 0.0 112.9 -179.641 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . 0.448 ' CE1' ' HG2' ' A' ' 53' ' ' PRO . 0.0 OUTLIER . . . . . 0 N--CA 1.471 0.597 0 CA-C-O 120.916 0.389 . . . . 0.0 111.649 -179.573 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 45.1 p . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.763 0.316 . . . . 0.0 111.045 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . 0.461 ' HA ' ' CD1' ' A' ' 24' ' ' TYR . 2.5 m 50.78 -177.3 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.814 -179.759 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.708 ' HB3' ' HB3' ' A' ' 23' ' ' CYS . 2.2 t -141.19 -94.81 0.14 Allowed 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 116.635 -0.257 . . . . 0.0 110.862 -179.858 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.557 ' CB ' HD13 ' A' ' 22' ' ' LEU . 1.6 t 54.25 172.75 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.164 0 CA-C-O 120.892 0.377 . . . . 0.0 111.56 179.394 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.402 ' N ' ' OG ' ' A' ' 61' ' ' SER . 1.2 m 74.64 79.07 0.11 Allowed 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.243 179.679 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . 0.42 ' HA ' ' CG1' ' A' ' 1' ' ' ILE . 11.5 m-20 52.36 -178.39 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.972 179.881 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.438 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 0.0 OUTLIER -57.35 88.79 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.683 179.851 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 3.2 p -92.13 42.56 1.11 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.466 -179.825 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.417 ' O ' ' CD2' ' A' ' 68' ' ' HIS . 2.3 m-20 -106.67 87.46 2.81 Favored Pre-proline 0 C--N 1.326 -0.433 0 C-N-CA 120.897 -0.321 . . . . 0.0 110.651 179.582 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -73.03 -4.6 15.71 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.727 2.285 . . . . 0.0 113.069 -179.64 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.441 ' HB3' ' HD2' ' A' ' 69' ' ' PRO . 0.3 OUTLIER 64.29 178.56 0.05 OUTLIER Pre-proline 0 C--N 1.331 -0.221 0 N-CA-C 110.396 -0.224 . . . . 0.0 110.396 -179.763 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . 0.441 ' HD2' ' HB3' ' A' ' 68' ' ' HIS . 77.7 Cg_exo -50.24 123.22 10.67 Favored 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.377 2.051 . . . . 0.0 112.479 -179.84 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.28 29.97 2.99 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.919 179.868 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.415 ' HB3' ' CE ' ' A' ' 38' ' ' LYS . 1.5 pp0? . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.068 -179.857 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 192' ' ' CYS . . . . . 0.714 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.0 OUTLIER . . . . . 0 CA--C 1.498 -1.043 0 CA-C-O 122.284 1.04 . . . . 0.0 112.038 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 193' ' ' CYS . . . . . 0.714 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.0 OUTLIER 44.72 49.79 6.35 Favored Pre-proline 0 N--CA 1.435 -1.201 0 CA-C-N 113.073 -1.876 . . . . 0.0 112.412 174.05 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 194' ' ' PRO . . . . . 0.507 ' HD3' ' N ' ' B' ' 193' ' ' CYS . 64.0 Cg_endo -87.24 -25.21 1.09 Allowed 'Trans proline' 0 N--CA 1.459 -0.531 0 C-N-CA 122.596 2.197 . . . . 0.0 112.362 179.671 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -94.69 -173.86 3.13 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.265 -179.611 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 196' ' ' THR . . . . . 0.643 ' N ' ' HD3' ' B' ' 197' ' ' PRO . 0.2 OUTLIER -160.36 48.78 0.26 Allowed Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.634 -179.915 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 197' ' ' PRO . . . . . 0.643 ' HD3' ' N ' ' B' ' 196' ' ' THR . 6.0 Cg_exo -74.93 16.75 0.63 Allowed 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 121.879 1.719 . . . . 0.0 108.768 176.182 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 198' ' ' TYR . . . . . 0.58 ' H ' ' C ' ' B' ' 196' ' ' THR . 11.9 t80 . . . . . 0 C--O 1.25 1.08 0 CA-C-N 113.771 -1.559 . . . . 0.0 111.326 -178.659 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.382 0 CA-C-O 120.816 0.341 . . . . 0.0 111.01 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . 0.513 HG12 ' N ' ' A' ' 3' ' ' CYS . 60.9 t 63.4 159.19 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.826 -179.653 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.513 ' N ' HG12 ' A' ' 2' ' ' VAL . 38.6 m -96.05 177.4 5.75 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.666 -179.657 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' HIS . . . . . 0.491 ' NE2' ' O ' ' A' ' 63' ' ' ASP . 0.0 OUTLIER -135.62 160.97 36.85 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.652 -0.249 . . . . 0.0 110.594 179.835 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.452 ' C ' ' O ' ' A' ' 4' ' ' HIS . 20.5 p -21.96 134.43 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 113.373 0.879 . . . . 0.0 113.373 -179.753 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 3.7 t -101.02 -15.13 17.56 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.266 178.852 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.729 ' HB1' ' HG3' ' B' ' 194' ' ' PRO . . . -63.85 -161.73 0.01 OUTLIER 'General case' 0 C--O 1.232 0.142 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.905 179.718 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.595 HG21 ' HB3' ' B' ' 197' ' ' PRO . 2.8 t . . . . . 0 CA--C 1.531 0.234 0 CA-C-N 116.81 -0.177 . . . . 0.0 111.3 179.787 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo . . . . . 0 N--CA 1.46 -0.449 0 N-CA-C 112.716 0.237 . . . . 0.0 112.716 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -78.0 -63.34 0.03 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.572 0 C-N-CA 122.263 1.976 . . . . 0.0 111.709 179.375 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -134.3 17.01 4.33 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.96 -0.638 . . . . 0.0 112.191 179.32 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.425 ' O ' ' CG ' ' A' ' 21' ' ' ASN . 0.0 OUTLIER 173.17 -165.88 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.702 0.287 . . . . 0.0 110.729 -179.895 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.488 ' HA ' ' HA ' ' A' ' 46' ' ' ALA . 1.4 p30 67.18 3.93 3.42 Favored 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 112.718 0.636 . . . . 0.0 112.718 179.576 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.679 HD22 ' HB2' ' A' ' 61' ' ' SER . 0.8 OUTLIER 39.04 -161.89 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 178.881 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.461 ' H ' ' H ' ' A' ' 61' ' ' SER . 0.1 OUTLIER -121.28 -11.41 8.8 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.008 -179.935 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.556 ' HB2' ' H ' ' A' ' 44' ' ' CYS . 0.9 OUTLIER 46.54 -174.83 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 120.785 0.326 . . . . 0.0 111.229 -179.738 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.461 ' CD ' ' HG3' ' A' ' 67' ' ' PRO . 14.3 ttt-85 172.56 94.77 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.892 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.411 ' CG ' ' N ' ' A' ' 27' ' ' MET . 0.3 OUTLIER -62.11 163.97 7.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.276 179.483 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . 0.411 ' N ' ' CG ' ' A' ' 26' ' ' LYS . 66.0 ttp -153.71 163.27 40.29 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.607 179.685 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' TRP . . . . . 0.417 ' CE3' ' HB3' ' A' ' 30' ' ' ASP . 0.0 OUTLIER -114.98 -74.15 0.62 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.06 179.963 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 1.5 m 60.32 52.0 5.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.913 0.387 . . . . 0.0 110.715 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.417 ' HB3' ' CE3' ' A' ' 28' ' ' TRP . 3.6 p30 -87.41 157.5 19.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.097 -179.85 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . 57.16 52.44 8.99 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.162 179.712 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER 56.26 97.43 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.795 179.962 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.42 ' O ' ' N ' ' A' ' 35' ' ' SER . 0.3 OUTLIER -56.56 -73.72 0.06 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.058 -179.827 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 16.3 t 55.08 -85.89 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.014 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.42 ' N ' ' O ' ' A' ' 33' ' ' CYS . 56.7 p -101.09 23.82 10.26 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.867 0.365 . . . . 0.0 110.769 179.663 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.411 ' CA ' ' HE3' ' A' ' 70' ' ' LYS . 0.2 OUTLIER -119.7 -163.07 0.96 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.499 179.987 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 122.01 11.38 5.83 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.545 -0.836 . . . . 0.0 112.85 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.245 0 CA-C-O 121.037 0.446 . . . . 0.0 110.762 179.797 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . 0.457 ' HA3' ' CB ' ' A' ' 24' ' ' TYR . . . . . . . . 0 N--CA 1.45 -0.405 0 CA-C-O 120.289 -0.173 . . . . 0.0 113.184 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.556 ' H ' ' HB2' ' A' ' 24' ' ' TYR . 24.3 t 51.86 86.94 0.03 OUTLIER 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 117.081 0.44 . . . . 0.0 110.166 -179.539 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.424 ' O ' ' HA ' ' A' ' 21' ' ' ASN . . . -153.56 155.91 37.04 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.966 0.412 . . . . 0.0 111.989 -178.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.488 ' HA ' ' HA ' ' A' ' 21' ' ' ASN . . . -85.66 80.13 9.11 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.436 179.941 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.45 ' OG1' ' N ' ' A' ' 48' ' ' CYS . 0.6 OUTLIER -170.58 -179.61 2.99 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.649 179.831 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.676 ' O ' ' N ' ' A' ' 50' ' ' SER . 0.5 OUTLIER 179.02 -48.24 0.0 OUTLIER Pre-proline 0 C--N 1.333 -0.148 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.568 179.934 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.426 ' CD ' ' N ' ' A' ' 48' ' ' CYS . 53.8 Cg_exo -52.28 72.56 0.02 OUTLIER 'Trans proline' 0 C--N 1.351 0.694 0 C-N-CA 122.083 1.855 . . . . 0.0 111.067 179.685 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.676 ' N ' ' O ' ' A' ' 48' ' ' CYS . 28.7 t -118.63 -80.01 0.61 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.378 -0.828 . . . . 0.0 111.258 -178.342 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 10.2 mtmm 58.91 34.21 23.51 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.836 0.351 . . . . 0.0 111.043 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.41 162.44 33.69 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.809 179.925 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -60.32 -67.84 0.05 OUTLIER 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.494 2.129 . . . . 0.0 112.117 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.468 0.428 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.134 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.143 0 CA-C-O 120.868 0.366 . . . . 0.0 111.35 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . 0.489 ' HA ' ' CD1' ' A' ' 24' ' ' TYR . 1.2 m -50.97 138.76 18.67 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.939 179.67 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.611 ' SG ' ' N ' ' A' ' 65' ' ' CYS . 48.5 t -112.07 -83.91 0.58 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.708 -179.593 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.679 ' HB2' HD22 ' A' ' 22' ' ' LEU . 47.0 t 65.65 -148.32 0.22 Allowed 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.138 -179.32 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.528 HG23 ' O ' ' A' ' 61' ' ' SER . 0.2 OUTLIER 49.09 -86.82 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 122.147 0.179 . . . . 0.0 111.22 -179.806 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . 0.491 ' O ' ' NE2' ' A' ' 4' ' ' HIS . 1.6 p30 -153.64 79.03 1.15 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.666 0.269 . . . . 0.0 111.659 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.5 ' HB2' ' HB3' ' A' ' 3' ' ' CYS . 0.0 OUTLIER 41.19 23.61 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.788 0.662 . . . . 0.0 112.788 179.365 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . 0.611 ' N ' ' SG ' ' A' ' 60' ' ' CYS . 0.5 OUTLIER 69.82 -42.39 0.51 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.722 0.296 . . . . 0.0 111.016 179.998 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.617 ' N ' ' HD3' ' A' ' 67' ' ' PRO . 0.9 OUTLIER 57.37 53.33 6.29 Favored Pre-proline 0 C--O 1.232 0.179 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.677 -179.659 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . 0.617 ' HD3' ' N ' ' A' ' 66' ' ' ASN . 19.5 Cg_endo -92.29 -66.36 0.01 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.945 0 C-N-CA 123.075 2.517 . . . . 0.0 111.521 179.148 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.592 ' HB3' ' HD2' ' A' ' 69' ' ' PRO . 82.5 m-70 58.21 166.24 0.07 OUTLIER Pre-proline 0 C--N 1.331 -0.197 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.087 179.148 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . 0.592 ' HD2' ' HB3' ' A' ' 68' ' ' HIS . 28.2 Cg_exo -35.15 123.72 0.21 Allowed 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 123.1 2.533 . . . . 0.0 113.145 -179.798 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.413 ' HD3' ' N ' ' A' ' 71' ' ' GLN . 0.0 OUTLIER -98.08 -7.18 30.2 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.236 -179.964 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.413 ' N ' ' HD3' ' A' ' 70' ' ' LYS . 2.1 tt0 . . . . . 0 C--N 1.332 -0.187 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.424 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 192' ' ' CYS . . . . . 0.706 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.5 OUTLIER . . . . . 0 CA--C 1.497 -1.077 0 CA-C-O 121.798 0.809 . . . . 0.0 112.007 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 193' ' ' CYS . . . . . 0.706 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.0 OUTLIER -153.98 103.17 2.46 Favored Pre-proline 0 N--CA 1.436 -1.15 0 CA-C-N 113.734 -1.576 . . . . 0.0 111.964 -173.444 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 194' ' ' PRO . . . . . 0.729 ' HG3' ' HB1' ' A' ' 7' ' ' ALA . 38.3 Cg_endo -81.74 -66.7 0.02 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.768 0 C-N-CA 122.395 2.063 . . . . 0.0 111.979 179.486 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -172.63 14.88 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 113.294 0.85 . . . . 0.0 113.294 179.819 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 196' ' ' THR . . . . . 0.591 ' C ' ' H ' ' B' ' 198' ' ' TYR . 1.4 t -147.2 36.85 0.17 Allowed Pre-proline 0 C--N 1.334 -0.094 0 C-N-CA 120.389 -0.524 . . . . 0.0 112.024 179.725 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 197' ' ' PRO . . . . . 0.595 ' HB3' HG21 ' A' ' 8' ' ' THR . 72.1 Cg_endo -72.2 13.7 0.51 Allowed 'Trans proline' 0 C--N 1.35 0.612 0 C-N-CA 121.518 1.478 . . . . 0.0 109.359 176.113 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 198' ' ' TYR . . . . . 0.591 ' H ' ' C ' ' B' ' 196' ' ' THR . 1.1 t80 . . . . . 0 C--O 1.248 0.976 0 CA-C-N 114.12 -1.4 . . . . 0.0 111.289 -178.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 1' ' ' ILE . . . . . 0.733 HD13 HG12 ' A' ' 2' ' ' VAL . 0.1 OUTLIER . . . . . 0 N--CA 1.485 1.309 0 CA-C-O 120.466 0.174 . . . . 0.0 110.812 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . 0.733 HG12 HD13 ' A' ' 1' ' ' ILE . 4.0 p 147.44 138.08 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 C-N-CA 123.461 0.705 . . . . 0.0 110.439 179.388 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.487 ' O ' ' C ' ' A' ' 4' ' ' HIS . 0.5 OUTLIER -160.08 54.01 0.34 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.68 -179.719 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' HIS . . . . . 0.487 ' C ' ' O ' ' A' ' 3' ' ' CYS . 4.9 p-80 -23.7 110.31 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 122.659 0.384 . . . . 0.0 112.033 179.627 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.6 t -44.82 149.86 0.4 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.07 -0.513 . . . . 0.0 111.319 -179.642 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.757 HG22 ' HB3' ' A' ' 66' ' ' ASN . 16.8 p -81.01 2.34 27.41 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.448 -179.935 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.507 ' C ' HG23 ' A' ' 8' ' ' THR . . . -58.19 88.69 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.727 0.299 . . . . 0.0 111.205 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.816 HG22 ' O ' ' B' ' 192' ' ' CYS . 1.2 p . . . . . 0 C--N 1.33 -0.262 0 CA-C-O 121.049 0.452 . . . . 0.0 111.206 179.55 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.535 ' CB ' ' HD3' ' A' ' 18' ' ' PRO . 10.5 Cg_exo . . . . . 0 CA--C 1.531 0.352 0 N-CA-C 112.98 0.339 . . . . 0.0 112.98 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.535 ' HD3' ' CB ' ' A' ' 17' ' ' PRO . 43.4 Cg_endo -97.16 -166.5 0.1 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.77 0 C-N-CA 122.818 2.345 . . . . 0.0 112.795 -179.4 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 78.33 -65.4 3.37 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.801 179.48 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -113.32 156.42 23.4 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.978 0.418 . . . . 0.0 111.207 -179.577 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.724 ' O ' HD13 ' A' ' 22' ' ' LEU . 0.2 OUTLIER -103.3 40.21 1.44 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.62 179.871 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.724 HD13 ' O ' ' A' ' 21' ' ' ASN . 0.6 OUTLIER 165.82 -172.99 0.02 OUTLIER 'General case' 0 N--CA 1.461 0.121 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.033 -179.692 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.575 ' HB2' ' C ' ' A' ' 60' ' ' CYS . 1.6 m -120.32 88.55 2.96 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.429 0.633 . . . . 0.0 111.292 -179.835 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.536 ' CD2' ' HB3' ' A' ' 45' ' ' ALA . 14.7 t80 -78.51 125.38 29.29 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.063 -0.971 . . . . 0.0 112.201 -179.254 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.659 ' NH1' HG22 ' A' ' 58' ' ' THR . 0.0 OUTLIER -155.97 137.72 14.29 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.651 -0.25 . . . . 0.0 110.653 179.263 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 4.5 mttt -80.04 145.25 32.58 Favored 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 120.901 -0.32 . . . . 0.0 110.922 -179.831 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . 0.457 ' HE1' ' HG2' ' A' ' 67' ' ' PRO . 50.1 tpp -153.49 146.05 24.14 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.332 -179.783 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' TRP . . . . . 0.445 ' O ' ' CB ' ' A' ' 29' ' ' CYS . 0.3 OUTLIER -149.04 -160.54 1.19 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.768 179.88 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . 0.641 ' HA ' ' HB3' ' A' ' 33' ' ' CYS . 0.1 OUTLIER 85.68 -17.6 0.4 Allowed 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 122.806 0.442 . . . . 0.0 111.724 -179.921 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.41 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 41.1 m-20 -54.19 126.73 24.05 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.776 0.322 . . . . 0.0 110.978 -179.91 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.41 ' HB3' ' O ' ' A' ' 30' ' ' ASP . . . 67.28 -72.29 0.09 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.878 -179.793 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.452 ' O ' ' SG ' ' A' ' 33' ' ' CYS . 18.6 m-85 -71.63 -164.24 0.12 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.34 179.647 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.641 ' HB3' ' HA ' ' A' ' 29' ' ' CYS . 0.5 OUTLIER 74.51 -50.12 0.67 Allowed 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 112.094 0.405 . . . . 0.0 112.094 179.554 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.402 ' N ' ' SG ' ' A' ' 33' ' ' CYS . 0.3 OUTLIER 53.73 55.6 8.28 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.871 0.367 . . . . 0.0 110.685 -179.854 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 67.28 35.2 4.5 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.14 -179.811 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -144.71 12.8 1.49 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.866 -179.909 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.432 ' N ' ' HB2' ' A' ' 33' ' ' CYS . . . -87.7 -52.39 3.0 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.647 -0.787 . . . . 0.0 112.862 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.468 0.435 0 CA-C-O 120.839 0.352 . . . . 0.0 111.111 -179.677 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.554 0 N-CA-C 110.165 -1.174 . . . . 0.0 110.165 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.507 ' N ' ' O ' ' A' ' 24' ' ' TYR . 0.1 OUTLIER 76.57 109.29 0.08 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.041 0.448 . . . . 0.0 110.49 -178.155 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.551 ' O ' ' N ' ' A' ' 47' ' ' THR . . . -173.5 147.11 1.42 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.137 -179.668 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.512 ' C ' HG22 ' A' ' 47' ' ' THR . . . 47.33 -82.43 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.709 179.394 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.551 ' N ' ' O ' ' A' ' 45' ' ' ALA . 1.2 t 156.76 62.19 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.402 179.821 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.537 ' CB ' HD23 ' A' ' 22' ' ' LEU . 49.6 t 43.91 53.51 10.41 Favored Pre-proline 0 N--CA 1.466 0.375 0 N-CA-C 111.787 0.292 . . . . 0.0 111.787 179.688 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.515 ' HD3' ' N ' ' A' ' 48' ' ' CYS . 37.4 Cg_exo -55.0 -25.45 44.6 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 121.984 1.789 . . . . 0.0 111.002 179.088 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 3.0 t -55.78 179.95 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.206 -0.906 . . . . 0.0 111.323 179.751 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 11.8 ptpt 175.89 -47.72 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.035 179.881 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.436 ' HB2' ' CE2' ' A' ' 54' ' ' TYR . 0.0 OUTLIER -75.02 149.27 85.08 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.974 -179.898 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -59.32 -47.66 16.34 Favored 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.59 2.194 . . . . 0.0 112.364 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . 0.436 ' CE2' ' HB2' ' A' ' 52' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.471 0.593 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.996 -179.751 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.659 HG22 ' NH1' ' A' ' 25' ' ' ARG . 8.9 t . . . . . 0 C--O 1.232 0.167 0 CA-C-O 120.72 0.295 . . . . 0.0 110.425 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -101.29 134.78 43.82 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.872 0.367 . . . . 0.0 110.292 179.681 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.575 ' C ' ' HB2' ' A' ' 23' ' ' CYS . 0.5 OUTLIER -123.45 15.68 9.65 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.448 -179.418 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.584 ' O ' HG23 ' A' ' 62' ' ' THR . 0.3 OUTLIER -64.94 95.16 0.15 Allowed 'General case' 0 C--N 1.333 -0.116 0 CA-C-O 121.057 0.456 . . . . 0.0 111.289 -179.123 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.584 HG23 ' O ' ' A' ' 61' ' ' SER . 0.1 OUTLIER 168.39 67.81 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.377 179.826 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . 0.621 ' HA ' HG13 ' A' ' 2' ' ' VAL . 1.2 t0 64.81 -163.91 0.25 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.551 -179.737 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.416 ' HB3' ' CE1' ' A' ' 4' ' ' HIS . 0.0 OUTLIER -60.74 87.59 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.88 0.371 . . . . 0.0 110.306 179.864 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 16.7 t -94.95 -50.01 5.3 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.941 -179.735 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.757 ' HB3' HG22 ' A' ' 6' ' ' THR . 29.4 m-20 -43.29 100.47 0.23 Allowed Pre-proline 0 N--CA 1.463 0.201 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.533 -179.761 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . 0.457 ' HG2' ' HE1' ' A' ' 27' ' ' MET . 95.6 Cg_endo -90.89 131.57 1.53 Allowed 'Trans proline' 0 N--CA 1.454 -0.797 0 C-N-CA 122.732 2.288 . . . . 0.0 112.059 -180.0 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 5.7 p80 -48.0 161.49 0.36 Allowed Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.726 179.83 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -47.21 173.07 0.03 OUTLIER 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.429 2.086 . . . . 0.0 112.083 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.436 ' O ' ' C ' ' A' ' 71' ' ' GLN . 0.0 OUTLIER -54.47 -27.35 36.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.034 -179.817 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.436 ' C ' ' O ' ' A' ' 70' ' ' LYS . 22.8 tp60 . . . . . 0 N--CA 1.469 0.487 0 O-C-N 123.571 0.544 . . . . 0.0 112.388 179.78 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 192' ' ' CYS . . . . . 0.816 ' O ' HG22 ' A' ' 8' ' ' THR . 0.0 OUTLIER . . . . . 0 CA--C 1.498 -1.036 0 CA-C-O 121.959 0.885 . . . . 0.0 111.467 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 193' ' ' CYS . . . . . 0.704 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.1 OUTLIER 44.67 178.26 0.0 OUTLIER Pre-proline 0 C--N 1.314 -0.972 0 CA-C-N 113.048 -1.887 . . . . 0.0 112.954 173.622 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 194' ' ' PRO . . . . . 0.599 ' O ' HG21 ' A' ' 8' ' ' THR . 95.2 Cg_endo -86.75 -178.62 2.68 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.815 2.343 . . . . 0.0 112.706 -179.469 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -116.09 -69.48 0.85 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.296 -179.858 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 196' ' ' THR . . . . . 0.601 ' C ' ' H ' ' B' ' 198' ' ' TYR . 12.8 t -143.05 40.79 0.34 Allowed Pre-proline 0 C--N 1.33 -0.256 0 N-CA-C 112.376 0.509 . . . . 0.0 112.376 -179.449 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 197' ' ' PRO . . . . . 0.526 ' CD ' ' N ' ' B' ' 196' ' ' THR . 73.8 Cg_endo -74.38 17.79 0.51 Allowed 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 121.52 1.48 . . . . 0.0 108.987 175.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 198' ' ' TYR . . . . . 0.601 ' H ' ' C ' ' B' ' 196' ' ' THR . 77.9 t80 . . . . . 0 C--O 1.249 1.079 0 CA-C-N 113.994 -1.457 . . . . 0.0 111.272 -178.915 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 1' ' ' ILE . . . . . 0.749 HG23 ' HA ' ' A' ' 62' ' ' THR . 27.2 mm . . . . . 0 N--CA 1.487 1.375 0 CA-C-O 120.899 0.38 . . . . 0.0 111.09 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . 0.612 HG22 ' H ' ' A' ' 3' ' ' CYS . 1.1 p -174.98 178.81 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.033 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.612 ' H ' HG22 ' A' ' 2' ' ' VAL . 0.1 OUTLIER -127.0 92.23 3.49 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 120.636 0.255 . . . . 0.0 111.656 -179.527 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' HIS . . . . . 0.489 ' CE1' ' HB2' ' A' ' 66' ' ' ASN . 75.0 m80 -39.58 147.22 0.08 Allowed 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.902 179.816 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 18.9 p -71.9 79.89 0.9 Allowed 'General case' 0 C--N 1.334 -0.085 0 CA-C-O 120.902 0.382 . . . . 0.0 111.411 -179.467 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.513 ' O ' ' HB3' ' A' ' 7' ' ' ALA . 4.7 p 63.31 7.48 2.91 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.734 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.513 ' HB3' ' O ' ' A' ' 6' ' ' THR . . . 73.83 -55.62 0.66 Allowed 'General case' 0 N--CA 1.462 0.174 0 N-CA-C 111.909 0.336 . . . . 0.0 111.909 179.506 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.424 ' C ' ' O ' ' A' ' 7' ' ' ALA . 33.9 p . . . . . 0 N--CA 1.468 0.455 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 -179.539 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_exo . . . . . 0 CA--C 1.533 0.454 0 N-CA-C 113.144 0.401 . . . . 0.0 113.144 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_exo -46.09 177.79 0.01 OUTLIER 'Trans proline' 0 C--N 1.35 0.608 0 C-N-CA 123.196 2.598 . . . . 0.0 113.33 -179.168 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 69.39 -158.72 53.23 Favored Glycine 0 N--CA 1.451 -0.345 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.981 -179.729 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -57.96 -166.18 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 110.209 -0.293 . . . . 0.0 110.209 179.424 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.576 ' CB ' ' HB2' ' A' ' 46' ' ' ALA . 0.0 OUTLIER 66.23 90.38 0.09 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.186 0.517 . . . . 0.0 109.724 -179.899 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.553 ' HB3' ' HB3' ' A' ' 60' ' ' CYS . 0.7 OUTLIER -112.52 178.12 4.4 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.315 0.578 . . . . 0.0 112.13 -178.9 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.574 ' O ' ' HB2' ' A' ' 60' ' ' CYS . 12.7 m -62.62 84.94 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.264 -0.88 . . . . 0.0 112.877 -178.278 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.531 ' HB3' ' HA ' ' A' ' 59' ' ' CYS . 40.0 p90 -68.09 70.24 0.15 Allowed 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.507 0.67 . . . . 0.0 109.298 178.153 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.463 ' N ' ' O ' ' A' ' 23' ' ' CYS . 0.0 OUTLIER -41.15 147.1 0.15 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.11 -0.95 . . . . 0.0 112.948 -178.347 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -130.48 171.89 12.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 114.974 -1.012 . . . . 0.0 109.547 179.065 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 2.3 ttp -160.53 -176.55 5.64 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.916 0.389 . . . . 0.0 111.574 -179.776 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' TRP . . . . . 0.431 ' HA ' ' CE3' ' A' ' 28' ' ' TRP . 0.4 OUTLIER -100.3 -164.35 1.11 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.246 -179.948 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER 69.7 -65.37 0.31 Allowed 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.809 -179.935 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 61.97 78.51 0.29 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.25 179.659 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . 48.89 45.01 22.53 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.447 179.631 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -152.23 -170.56 3.68 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.688 179.862 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 44.89 -170.76 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.448 179.822 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 47.7 t -89.58 -28.56 19.48 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.472 179.636 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.461 ' O ' ' N ' ' A' ' 37' ' ' GLY . 1.3 p -179.74 -49.58 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.796 179.814 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 30.87 -87.22 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.329 0.652 . . . . 0.0 112.496 179.614 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.461 ' N ' ' O ' ' A' ' 35' ' ' SER . . . 62.05 -105.76 1.03 Allowed Glycine 0 C--N 1.332 0.347 0 C-N-CA 120.508 -0.853 . . . . 0.0 112.781 179.795 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.487 ' HA ' ' HD2' ' A' ' 38' ' ' LYS . 0.4 OUTLIER . . . . . 0 N--CA 1.455 -0.209 0 CA-C-O 121.174 0.511 . . . . 0.0 111.745 179.944 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . 0.479 ' HA2' ' CZ ' ' A' ' 24' ' ' TYR . . . . . . . . 0 N--CA 1.448 -0.542 0 CA-C-O 120.658 0.032 . . . . 0.0 113.108 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.493 ' HA ' ' O ' ' A' ' 22' ' ' LEU . 52.5 t 74.72 88.01 0.09 Allowed 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.998 0.427 . . . . 0.0 110.503 -178.94 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.408 ' CB ' ' CE1' ' A' ' 24' ' ' TYR . . . -164.68 146.37 8.18 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.729 -0.668 . . . . 0.0 111.12 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.576 ' HB2' ' CB ' ' A' ' 21' ' ' ASN . . . -121.64 76.99 1.31 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.089 -179.796 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.797 HG23 ' HD3' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -172.49 -38.82 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.008 -179.888 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.414 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 5.7 m 59.41 52.32 3.78 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.396 179.532 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.797 ' HD3' HG23 ' A' ' 47' ' ' THR . 59.6 Cg_endo -71.97 -9.82 25.22 Favored 'Trans proline' 0 C--N 1.343 0.266 0 C-N-CA 122.315 2.01 . . . . 0.0 111.578 179.004 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 6.8 t -55.51 140.45 40.46 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.143 179.797 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -168.26 33.66 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.678 179.899 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.419 ' HB3' ' HD2' ' A' ' 53' ' ' PRO . 1.4 mttm -81.98 158.48 67.39 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.668 -179.887 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . 0.419 ' HD2' ' HB3' ' A' ' 52' ' ' LYS . 12.7 Cg_endo -56.35 -70.48 0.04 OUTLIER 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.527 2.151 . . . . 0.0 112.13 179.93 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . 0.406 ' CZ ' ' HG2' ' A' ' 53' ' ' PRO . 0.0 OUTLIER . . . . . 0 N--CA 1.468 0.466 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.132 -179.906 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 3.8 t . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.735 0.302 . . . . 0.0 110.876 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . 0.531 ' HA ' ' HB3' ' A' ' 24' ' ' TYR . 1.3 m 62.1 124.09 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.975 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.574 ' HB2' ' O ' ' A' ' 23' ' ' CYS . 4.6 t -84.91 -52.65 5.85 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.103 -179.679 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 53.09 99.62 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.314 179.646 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.749 ' HA ' HG23 ' A' ' 1' ' ' ILE . 46.7 p 40.69 96.66 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.902 179.689 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . 0.44 ' O ' ' CG ' ' A' ' 64' ' ' LYS . 1.0 OUTLIER 178.26 -13.14 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 179.634 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.473 ' O ' ' C ' ' A' ' 65' ' ' CYS . 3.8 ptmm? 46.65 31.75 1.48 Allowed 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 120.742 0.306 . . . . 0.0 110.839 -179.405 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . 0.473 ' C ' ' O ' ' A' ' 64' ' ' LYS . 0.1 OUTLIER -17.0 -65.36 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 115.459 -0.791 . . . . 0.0 112.674 -179.757 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.489 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 4.8 t-20 76.5 92.21 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.307 -179.848 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . 0.423 ' HD2' ' HB2' ' A' ' 7' ' ' ALA . 12.8 Cg_exo -69.4 -171.62 0.46 Allowed 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.759 2.306 . . . . 0.0 112.109 179.83 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 7.4 p80 176.71 158.57 0.46 Allowed Pre-proline 0 C--N 1.331 -0.224 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.839 179.805 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . 0.458 ' HB3' ' CE ' ' A' ' 38' ' ' LYS . 45.1 Cg_exo -55.57 136.35 73.63 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.509 2.139 . . . . 0.0 112.139 179.908 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.424 ' HG2' ' O ' ' A' ' 35' ' ' SER . 0.4 OUTLIER -92.79 -50.62 5.48 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.44 179.812 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.419 ' CB ' ' HG2' ' A' ' 38' ' ' LYS . 42.4 tp60 . . . . . 0 C--O 1.232 0.175 0 CA-C-O 120.846 0.355 . . . . 0.0 111.004 179.763 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 192' ' ' CYS . . . . . 0.697 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.0 OUTLIER . . . . . 0 CA--C 1.497 -1.073 0 CA-C-O 121.884 0.85 . . . . 0.0 111.587 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 193' ' ' CYS . . . . . 0.697 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.1 OUTLIER 43.14 81.65 0.24 Allowed Pre-proline 0 N--CA 1.439 -1.003 0 CA-C-N 113.452 -1.704 . . . . 0.0 112.161 173.75 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 194' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -86.44 30.67 0.48 Allowed 'Trans proline' 0 N--CA 1.461 -0.384 0 C-N-CA 123.054 2.503 . . . . 0.0 112.781 -179.878 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -162.45 71.57 0.32 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.876 0.369 . . . . 0.0 110.664 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 196' ' ' THR . . . . . 0.657 ' N ' ' HD3' ' B' ' 197' ' ' PRO . 65.2 p -143.36 47.93 0.88 Allowed Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.871 -179.875 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 197' ' ' PRO . . . . . 0.657 ' HD3' ' N ' ' B' ' 196' ' ' THR . 6.3 Cg_exo -73.95 13.5 0.8 Allowed 'Trans proline' 0 C--N 1.351 0.683 0 C-N-CA 121.674 1.583 . . . . 0.0 108.742 175.941 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 198' ' ' TYR . . . . . 0.596 ' H ' ' C ' ' B' ' 196' ' ' THR . 63.9 t80 . . . . . 0 C--O 1.249 1.049 0 CA-C-N 113.929 -1.487 . . . . 0.0 111.291 -178.803 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 1' ' ' ILE . . . . . 0.539 HG23 ' H ' ' A' ' 2' ' ' VAL . 2.1 tp . . . . . 0 N--CA 1.486 1.37 0 CA-C-O 120.593 0.235 . . . . 0.0 111.1 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . 0.634 HG13 ' N ' ' A' ' 3' ' ' CYS . 0.5 OUTLIER -178.97 -169.04 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.566 -0.288 . . . . 0.0 110.792 -179.933 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.634 ' N ' HG13 ' A' ' 2' ' ' VAL . 0.9 OUTLIER -147.16 -50.26 0.19 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.712 0.291 . . . . 0.0 111.302 179.971 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' HIS . . . . . 0.501 ' CD2' ' O ' ' A' ' 3' ' ' CYS . 3.4 p80 53.95 110.28 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.244 0.545 . . . . 0.0 111.029 -179.591 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.9 t -82.7 109.95 17.33 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.552 -179.029 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.413 ' CG2' ' HB3' ' B' ' 194' ' ' PRO . 4.0 m -93.55 17.77 11.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.356 179.659 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -59.76 84.78 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.785 0.326 . . . . 0.0 110.93 179.919 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 2.2 p . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.896 -179.711 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.613 ' N ' ' HD2' ' A' ' 18' ' ' PRO . 74.2 Cg_exo . . . . . 0 CA--C 1.531 0.355 0 N-CA-C 112.981 0.339 . . . . 0.0 112.981 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.613 ' HD2' ' N ' ' A' ' 17' ' ' PRO . 11.2 Cg_endo -55.37 -62.14 0.3 Allowed 'Trans proline' 0 C--N 1.349 0.575 0 C-N-CA 122.345 2.03 . . . . 0.0 112.498 -179.649 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.497 ' HA2' ' HA ' ' A' ' 46' ' ' ALA . . . -45.99 156.7 0.45 Allowed Glycine 0 C--N 1.331 0.25 0 C-N-CA 120.823 -0.703 . . . . 0.0 112.459 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.916 ' HG3' HD11 ' A' ' 22' ' ' LEU . 0.0 OUTLIER -99.4 48.96 0.94 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.031 0.444 . . . . 0.0 112.128 -179.314 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.547 ' C ' HD13 ' A' ' 22' ' ' LEU . 0.8 OUTLIER 77.72 60.52 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.744 -0.662 . . . . 0.0 112.441 178.357 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.916 HD11 ' HG3' ' A' ' 20' ' ' GLU . 0.0 OUTLIER -152.13 96.7 2.22 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 121.003 0.43 . . . . 0.0 111.605 178.366 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.562 ' HA ' ' HA ' ' A' ' 44' ' ' CYS . 9.5 m -87.77 44.81 1.22 Allowed 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.825 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.605 ' O ' ' CB ' ' A' ' 25' ' ' ARG . 0.2 OUTLIER 35.29 -89.31 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 179.535 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.605 ' CB ' ' O ' ' A' ' 24' ' ' TYR . 12.5 ttm-85 107.08 -59.69 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.331 0.652 . . . . 0.0 111.835 -179.959 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 61.53 123.89 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.541 -179.048 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 10.0 ptt? -144.41 137.59 27.13 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.003 0.43 . . . . 0.0 111.87 -179.65 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 4.3 t90 -136.41 142.54 43.69 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.426 179.399 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . 0.476 ' HA ' ' CB ' ' A' ' 33' ' ' CYS . 33.8 t 69.94 11.13 7.67 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.51 -179.822 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -97.97 44.82 1.03 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.778 0.323 . . . . 0.0 111.072 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -178.3 -88.32 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.983 179.753 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -96.63 76.47 2.85 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.996 0.427 . . . . 0.0 110.077 179.526 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.476 ' CB ' ' HA ' ' A' ' 29' ' ' CYS . 7.2 t -161.15 156.49 24.43 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.798 -179.119 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -51.35 -54.3 27.73 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.96 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 2.6 m -86.43 168.29 13.91 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.614 179.755 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.419 ' CG ' ' O ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -100.51 63.12 1.08 Allowed 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.363 -179.637 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.446 ' N ' ' O ' ' A' ' 29' ' ' CYS . . . 78.46 144.26 2.47 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.436 -0.887 . . . . 0.0 113.118 179.498 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.59 ' HA ' ' HG2' ' A' ' 70' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.308 0 CA-C-O 121.333 0.587 . . . . 0.0 109.83 179.574 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.52 0.345 0 CA-C-O 119.921 -0.377 . . . . 0.0 113.74 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.562 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 52.5 t 61.32 152.88 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 117.602 0.701 . . . . 0.0 111.496 179.752 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.574 ' O ' ' HB2' ' A' ' 46' ' ' ALA . . . -128.06 -79.37 0.58 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.743 179.745 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.575 ' CA ' HD21 ' A' ' 22' ' ' LEU . . . 168.01 -24.98 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.874 179.699 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 14.8 t -146.1 134.19 21.55 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.766 0.317 . . . . 0.0 111.438 -179.449 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.489 ' O ' ' N ' ' A' ' 50' ' ' SER . 11.3 m -78.99 -47.11 1.69 Allowed Pre-proline 0 C--N 1.333 -0.142 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.732 179.552 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.486 ' HD3' ' HB2' ' A' ' 48' ' ' CYS . 17.3 Cg_exo -65.97 59.76 0.44 Allowed 'Trans proline' 0 C--N 1.349 0.585 0 C-N-CA 122.335 2.024 . . . . 0.0 110.374 178.701 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.489 ' N ' ' O ' ' A' ' 48' ' ' CYS . 23.0 t -93.65 -41.23 9.83 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 115.231 -0.895 . . . . 0.0 111.018 -178.615 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.528 ' O ' ' CB ' ' A' ' 52' ' ' LYS . 4.3 mmtm -141.47 -80.12 0.25 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.712 179.747 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.71 ' HB2' ' HD3' ' A' ' 53' ' ' PRO . 4.9 mtpp 107.29 -56.92 0.0 OUTLIER Pre-proline 0 N--CA 1.474 0.759 0 C-N-CA 123.954 0.902 . . . . 0.0 111.355 179.735 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . 0.71 ' HD3' ' HB2' ' A' ' 52' ' ' LYS . 39.4 Cg_exo -59.83 -156.65 0.02 OUTLIER 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 122.06 1.84 . . . . 0.0 111.971 179.641 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.468 0.474 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.598 179.691 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.456 -0.143 0 CA-C-O 120.916 0.389 . . . . 0.0 110.441 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 2.7 m 68.99 168.04 0.28 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.581 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.499 ' HB3' ' HB2' ' A' ' 23' ' ' CYS . 0.1 OUTLIER -162.18 36.14 0.12 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.742 0.306 . . . . 0.0 111.495 -179.374 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.549 ' C ' HG23 ' A' ' 62' ' ' THR . 0.1 OUTLIER -74.72 -163.0 0.18 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.655 0.264 . . . . 0.0 111.222 -179.916 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.549 HG23 ' C ' ' A' ' 61' ' ' SER . 1.4 p 77.71 27.99 0.58 Allowed 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.224 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 16.2 t70 60.68 149.66 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.572 179.288 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 29.53 87.39 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 115.631 -0.713 . . . . 0.0 112.517 179.57 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . 0.432 ' CB ' ' O ' ' A' ' 60' ' ' CYS . 49.0 t -123.4 -10.49 7.97 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.297 179.77 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.54 ' N ' ' HD2' ' A' ' 67' ' ' PRO . 12.3 m-80 -63.07 -57.06 22.87 Favored Pre-proline 0 CA--C 1.531 0.236 0 CA-C-N 116.578 -0.283 . . . . 0.0 111.534 -179.913 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . 0.54 ' HD2' ' N ' ' A' ' 66' ' ' ASN . 1.3 Cg_endo -42.83 165.4 0.03 OUTLIER 'Trans proline' 0 C--N 1.349 0.58 0 C-N-CA 122.992 2.461 . . . . 0.0 112.94 -179.65 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.52 ' N ' ' HD3' ' A' ' 69' ' ' PRO . 2.2 m-70 57.57 51.81 5.08 Favored Pre-proline 0 C--N 1.331 -0.197 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.064 -179.801 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . 0.52 ' HD3' ' N ' ' A' ' 68' ' ' HIS . 96.6 Cg_endo -86.63 -47.6 0.04 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.595 0 C-N-CA 122.479 2.12 . . . . 0.0 113.105 -179.697 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.59 ' HG2' ' HA ' ' A' ' 38' ' ' LYS . 0.0 OUTLIER -179.01 -164.12 0.07 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.662 -179.051 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.53 0.205 0 N-CA-C 111.7 0.259 . . . . 0.0 111.7 179.441 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 192' ' ' CYS . . . . . 0.697 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.0 OUTLIER . . . . . 0 CA--C 1.498 -1.029 0 CA-C-O 121.752 0.787 . . . . 0.0 110.985 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 193' ' ' CYS . . . . . 0.697 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.1 OUTLIER 41.31 73.36 0.9 Allowed Pre-proline 0 C--N 1.314 -0.946 0 CA-C-N 113.625 -1.625 . . . . 0.0 112.172 173.706 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 194' ' ' PRO . . . . . 0.413 ' HB3' ' CG2' ' A' ' 6' ' ' THR . 36.2 Cg_endo -65.06 -87.42 0.0 OUTLIER 'Trans proline' 0 CA--C 1.531 0.331 0 C-N-CA 122.555 2.17 . . . . 0.0 112.391 -179.749 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 30.9 t0 -106.14 13.64 28.74 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.566 0.222 . . . . 0.0 111.539 -179.805 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 196' ' ' THR . . . . . 0.762 ' C ' ' H ' ' B' ' 198' ' ' TYR . 77.3 p -79.89 -22.32 0.36 Allowed Pre-proline 0 C--N 1.331 -0.208 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 179.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 197' ' ' PRO . . . . . 0.664 ' CD ' ' N ' ' B' ' 196' ' ' THR . 17.2 Cg_exo -64.73 27.87 0.08 OUTLIER 'Trans proline' 0 C--N 1.355 0.878 0 C-N-CA 121.329 1.353 . . . . 0.0 109.622 177.172 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 198' ' ' TYR . . . . . 0.762 ' H ' ' C ' ' B' ' 196' ' ' THR . 13.0 t80 . . . . . 0 C--O 1.249 1.026 0 CA-C-N 114.283 -1.326 . . . . 0.0 111.28 -178.739 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 1' ' ' ILE . . . . . 0.534 HG21 ' C ' ' A' ' 62' ' ' THR . 1.2 mm . . . . . 0 N--CA 1.487 1.419 0 CA-C-O 120.758 0.313 . . . . 0.0 110.781 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -96.41 146.95 6.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.921 -179.818 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 29.2 p -127.0 116.45 20.78 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 112.37 0.507 . . . . 0.0 112.37 -178.68 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' HIS . . . . . 0.447 ' CE1' ' ND2' ' A' ' 66' ' ' ASN . 0.6 OUTLIER -46.35 166.3 0.02 OUTLIER 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.278 179.163 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 21.2 p -88.91 126.09 35.23 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.924 -179.843 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -121.04 28.82 7.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.069 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -48.26 -30.36 4.71 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 121.018 0.437 . . . . 0.0 111.046 179.797 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 88.0 m . . . . . 0 C--N 1.328 -0.359 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.239 179.702 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.448 ' HB3' ' O ' ' A' ' 21' ' ' ASN . 69.3 Cg_endo . . . . . 0 N--CA 1.456 -0.721 0 N-CA-C 113.723 0.624 . . . . 0.0 113.723 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.433 ' O ' ' N ' ' A' ' 20' ' ' GLU . 49.3 Cg_endo -68.56 162.86 39.1 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.013 1.809 . . . . 0.0 111.106 178.808 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 53.26 -88.45 0.01 OUTLIER Glycine 0 CA--C 1.519 0.295 0 C-N-CA 120.528 -0.844 . . . . 0.0 112.518 -179.866 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.433 ' N ' ' O ' ' A' ' 18' ' ' PRO . 14.5 mt-10 -140.07 111.82 7.41 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.807 0.337 . . . . 0.0 110.884 179.842 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.493 ' O ' ' C ' ' A' ' 22' ' ' LEU . 0.7 OUTLIER -178.5 34.09 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.081 179.904 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.789 HD23 ' O ' ' A' ' 47' ' ' THR . 0.2 OUTLIER -12.85 124.94 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 -179.822 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.581 ' O ' ' N ' ' A' ' 44' ' ' CYS . 0.1 OUTLIER -43.65 -29.41 0.5 Allowed 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.898 -179.691 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.509 ' CD2' ' HB2' ' A' ' 45' ' ' ALA . 0.2 OUTLIER 60.58 126.4 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.997 0.427 . . . . 0.0 111.344 179.51 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 3.0 ttt180 -117.21 78.06 1.18 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.801 179.75 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 2.9 mtmm -64.67 154.55 36.2 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.13 -179.83 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 1.8 ttm -157.5 100.45 1.8 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.52 179.862 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -56.42 -36.74 69.3 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.476 -179.544 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER 59.63 -168.4 0.15 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.826 0.346 . . . . 0.0 110.72 179.914 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 26.7 p-10 -91.71 -38.3 12.49 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.816 179.847 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -171.93 -56.08 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.809 179.855 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -131.96 17.48 4.64 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.974 179.58 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 93.0 m 56.84 165.76 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.945 0.402 . . . . 0.0 111.337 179.755 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 11.4 p 172.13 -34.16 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.499 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -161.36 -43.74 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.584 179.937 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.53 -172.22 1.75 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.967 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.411 ' O ' ' C ' ' A' ' 38' ' ' LYS . . . 169.69 -38.62 0.2 Allowed Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 121.141 -0.552 . . . . 0.0 111.887 -179.844 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.634 ' HA ' ' HB2' ' A' ' 70' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.467 0.387 0 N-CA-C 113.534 0.938 . . . . 0.0 113.534 179.673 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.195 0 N-CA-C 113.241 0.056 . . . . 0.0 113.241 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.581 ' N ' ' O ' ' A' ' 23' ' ' CYS . 13.7 m 60.61 152.56 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.075 0.464 . . . . 0.0 111.659 179.045 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.525 ' O ' ' HB2' ' A' ' 46' ' ' ALA . . . -133.0 -77.97 0.49 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.997 179.96 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.525 ' HB2' ' O ' ' A' ' 45' ' ' ALA . . . 170.75 -31.26 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.347 179.924 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.789 ' O ' HD23 ' A' ' 22' ' ' LEU . 13.5 t -141.35 -165.55 1.99 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.345 -179.686 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.547 ' H ' ' HD2' ' A' ' 49' ' ' PRO . 34.5 t -148.03 -60.46 0.02 OUTLIER Pre-proline 0 C--N 1.331 -0.205 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.494 -179.993 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.547 ' HD2' ' H ' ' A' ' 48' ' ' CYS . 3.4 Cg_exo -39.66 -26.83 0.17 Allowed 'Trans proline' 0 C--N 1.353 0.77 0 C-N-CA 122.519 2.146 . . . . 0.0 111.52 179.083 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.477 ' HB2' HG23 ' A' ' 47' ' ' THR . 0.9 OUTLIER -41.47 136.05 1.89 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.42 178.708 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 170.63 59.81 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.915 0.388 . . . . 0.0 111.043 179.62 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.525 ' HB2' ' HD3' ' A' ' 53' ' ' PRO . 0.0 OUTLIER -97.14 -67.07 0.07 OUTLIER Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.101 179.878 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . 0.525 ' HD3' ' HB2' ' A' ' 52' ' ' LYS . 72.2 Cg_endo -76.14 166.52 27.66 Favored 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 122.132 1.888 . . . . 0.0 112.286 179.907 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.469 0.49 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.935 179.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.529 0.168 0 CA-C-O 120.771 0.319 . . . . 0.0 111.075 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 7.8 t 49.61 97.47 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.719 179.674 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.407 ' HB3' ' HB3' ' A' ' 23' ' ' CYS . 21.1 t -84.71 -108.71 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 179.162 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.67 ' CB ' HD12 ' A' ' 22' ' ' LEU . 2.8 p 69.62 -59.22 0.5 Allowed 'General case' 0 N--CA 1.463 0.191 0 N-CA-C 111.955 0.354 . . . . 0.0 111.955 179.187 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.534 ' C ' HG21 ' A' ' 1' ' ' ILE . 23.8 p -51.56 -173.55 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.938 0.399 . . . . 0.0 111.6 -179.403 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . 0.468 ' N ' HG21 ' A' ' 1' ' ' ILE . 2.0 p30 -39.88 160.1 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.754 -179.56 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 29.6 mtpt -40.73 92.49 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.484 -179.619 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . 0.438 ' N ' ' O ' ' A' ' 63' ' ' ASP . 4.1 m -38.75 -40.78 0.65 Allowed 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.247 -179.914 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.447 ' ND2' ' CE1' ' A' ' 4' ' ' HIS . 1.0 OUTLIER 43.23 55.29 11.21 Favored Pre-proline 0 N--CA 1.463 0.196 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.577 179.621 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -71.6 -8.32 22.97 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.424 2.083 . . . . 0.0 112.532 179.935 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 21.7 m170 60.19 158.83 0.11 Allowed Pre-proline 0 C--N 1.332 -0.189 0 CA-C-N 116.53 -0.304 . . . . 0.0 110.591 -179.835 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . 0.489 ' HG2' ' HA ' ' B' ' 194' ' ' PRO . 67.1 Cg_exo -43.65 -66.43 0.16 Allowed 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.601 2.201 . . . . 0.0 113.106 -179.45 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.634 ' HB2' ' HA ' ' A' ' 38' ' ' LYS . 0.0 OUTLIER -134.73 178.91 6.64 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 120.645 0.26 . . . . 0.0 110.939 -179.408 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.467 ' N ' ' HG2' ' A' ' 70' ' ' LYS . 14.5 tp60 . . . . . 0 N--CA 1.463 0.218 0 N-CA-C 111.915 0.339 . . . . 0.0 111.915 -179.597 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 192' ' ' CYS . . . . . 0.724 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.2 OUTLIER . . . . . 0 CA--C 1.502 -0.871 0 CA-C-O 121.652 0.739 . . . . 0.0 112.431 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 193' ' ' CYS . . . . . 0.724 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.0 OUTLIER -157.45 170.98 8.06 Favored Pre-proline 0 N--CA 1.438 -1.027 0 CA-C-N 114.055 -1.43 . . . . 0.0 111.737 -173.209 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 194' ' ' PRO . . . . . 0.489 ' HA ' ' HG2' ' A' ' 69' ' ' PRO . 1.5 Cg_endo -44.36 -70.85 0.06 OUTLIER 'Trans proline' 0 C--N 1.35 0.658 0 C-N-CA 123.149 2.566 . . . . 0.0 112.807 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -144.37 -85.73 0.13 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.004 -179.682 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 196' ' ' THR . . . . . 0.594 ' C ' ' H ' ' B' ' 198' ' ' TYR . 0.2 OUTLIER -157.06 43.53 0.18 Allowed Pre-proline 0 C--N 1.332 -0.185 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.817 -179.722 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 197' ' ' PRO . . . . . 0.491 ' CD ' ' N ' ' B' ' 196' ' ' THR . 72.7 Cg_endo -74.13 17.18 0.52 Allowed 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 121.627 1.551 . . . . 0.0 109.016 176.203 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 198' ' ' TYR . . . . . 0.594 ' H ' ' C ' ' B' ' 196' ' ' THR . 29.6 t80 . . . . . 0 C--O 1.249 1.064 0 CA-C-N 113.875 -1.512 . . . . 0.0 111.357 -178.781 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 1' ' ' ILE . . . . . 0.913 HG22 HD11 ' A' ' 22' ' ' LEU . 1.3 tp . . . . . 0 N--CA 1.487 1.407 0 CA-C-O 120.508 0.194 . . . . 0.0 111.079 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . 0.686 HG12 HG13 ' A' ' 1' ' ' ILE . 9.9 p 177.08 147.0 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.517 -0.31 . . . . 0.0 110.847 179.902 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -154.9 131.1 10.31 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.77 0.319 . . . . 0.0 111.265 -179.847 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 59.2 m-70 -48.69 171.75 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.944 179.712 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -75.58 -167.46 0.68 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.661 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.607 ' O ' ' HB3' ' A' ' 7' ' ' ALA . 9.6 t -46.07 -25.05 0.51 Allowed 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.364 179.819 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.607 ' HB3' ' O ' ' A' ' 6' ' ' THR . . . 83.36 78.89 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.534 179.71 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.2 179.234 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.442 ' N ' ' CD ' ' A' ' 18' ' ' PRO . 28.4 Cg_exo . . . . . 0 CA--C 1.53 0.28 0 N-CA-C 112.562 0.178 . . . . 0.0 112.562 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.442 ' CD ' ' N ' ' A' ' 17' ' ' PRO . 41.5 Cg_exo -56.74 175.1 0.32 Allowed 'Trans proline' 0 C--N 1.347 0.492 0 C-N-CA 122.394 2.063 . . . . 0.0 112.351 179.935 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 55.47 -166.69 3.2 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.872 -0.68 . . . . 0.0 112.819 179.756 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.785 ' N ' ' HB2' ' A' ' 46' ' ' ALA . 1.6 tt0 -159.8 22.93 0.18 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.636 0.255 . . . . 0.0 111.064 179.869 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.482 ' N ' ' O ' ' A' ' 45' ' ' ALA . 4.8 m120 -137.02 10.0 3.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.318 179.612 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.913 HD11 HG22 ' A' ' 1' ' ' ILE . 0.0 OUTLIER 70.11 -172.18 0.17 Allowed 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 112.846 0.684 . . . . 0.0 112.846 178.841 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.553 ' HA ' ' HA ' ' A' ' 44' ' ' CYS . 56.3 m -59.88 175.61 0.37 Allowed 'General case' 0 N--CA 1.46 0.048 0 CA-C-N 114.863 -1.062 . . . . 0.0 112.002 -179.738 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.603 ' CZ ' ' HB3' ' A' ' 45' ' ' ALA . 4.3 m-30 -119.17 -54.52 2.2 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.42 179.476 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.437 ' CG ' ' O ' ' A' ' 24' ' ' TYR . 0.0 OUTLIER 78.18 170.98 0.2 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.967 -179.041 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 177.95 74.93 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.447 -179.523 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 22.7 mtp -81.86 -176.37 6.07 Favored 'General case' 0 C--N 1.321 -0.644 0 C-N-CA 120.459 -0.496 . . . . 0.0 111.169 -179.416 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' TRP . . . . . 0.473 ' HA ' ' CE3' ' A' ' 28' ' ' TRP . 0.0 OUTLIER -133.38 86.93 2.34 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.503 179.885 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . 0.448 ' HA ' ' HG2' ' A' ' 36' ' ' ARG . 0.1 OUTLIER -148.34 66.29 1.08 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.587 -179.74 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.428 ' HB2' ' CZ3' ' A' ' 28' ' ' TRP . 1.2 t0 -52.08 90.51 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.845 -179.275 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . 38.9 -90.54 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.008 -0.542 . . . . 0.0 112.208 179.434 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.426 ' N ' ' O ' ' A' ' 30' ' ' ASP . 0.2 OUTLIER -64.07 79.7 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.983 0.42 . . . . 0.0 110.758 179.998 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 66.1 m -71.04 -73.44 0.17 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.909 -179.864 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.8 m 69.04 -64.8 0.31 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.918 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 45.7 m -137.55 53.89 1.84 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.974 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.448 ' HG2' ' HA ' ' A' ' 29' ' ' CYS . 2.1 tpt180 -100.29 -149.8 0.37 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.76 179.864 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -159.92 144.4 10.06 Favored Glycine 0 C--N 1.334 0.418 0 C-N-CA 120.294 -0.955 . . . . 0.0 112.844 -179.68 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.546 ' HB2' ' CB ' ' A' ' 70' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.296 0 CA-C-O 121.135 0.493 . . . . 0.0 111.36 -179.759 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . 0.414 ' HA3' ' HB2' ' A' ' 24' ' ' TYR . . . . . . . . 0 N--CA 1.45 -0.371 0 N-CA-C 112.468 -0.253 . . . . 0.0 112.468 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.553 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 10.8 t 66.24 117.0 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.609 0.242 . . . . 0.0 110.814 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.603 ' HB3' ' CZ ' ' A' ' 24' ' ' TYR . . . -164.51 -170.32 2.0 Favored 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 120.618 -0.433 . . . . 0.0 111.83 -179.976 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.785 ' HB2' ' N ' ' A' ' 20' ' ' GLU . . . -132.17 34.55 3.78 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.215 -179.851 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.457 HG22 ' O ' ' A' ' 47' ' ' THR . 2.5 m -171.93 94.92 0.15 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.576 -179.691 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.48 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 1.8 t -147.24 46.06 0.47 Allowed Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.987 179.909 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.48 ' CD ' ' N ' ' A' ' 48' ' ' CYS . 87.0 Cg_endo -79.11 -5.38 14.43 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.396 2.064 . . . . 0.0 111.447 178.613 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 6.3 t -65.74 163.73 15.99 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.318 -179.703 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.559 ' O ' ' CB ' ' A' ' 52' ' ' LYS . 0.5 OUTLIER 172.36 175.35 0.09 Allowed 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.828 179.669 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.559 ' CB ' ' O ' ' A' ' 51' ' ' LYS . 4.8 mtpm? 115.79 -48.32 0.0 OUTLIER Pre-proline 0 N--CA 1.475 0.824 0 C-N-CA 124.171 0.989 . . . . 0.0 111.425 179.84 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . 0.504 ' HD3' ' HB2' ' A' ' 52' ' ' LYS . 24.9 Cg_exo -62.28 139.61 78.46 Favored 'Trans proline' 0 C--N 1.349 0.575 0 C-N-CA 122.131 1.887 . . . . 0.0 111.994 179.893 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.469 0.485 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.865 -179.894 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 4.1 p . . . . . 0 CA--C 1.53 0.18 0 N-CA-C 111.614 0.228 . . . . 0.0 111.614 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 3.9 m 58.33 150.41 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.143 0 CA-C-O 121.011 0.434 . . . . 0.0 110.937 179.62 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.423 ' O ' ' O ' ' A' ' 21' ' ' ASN . 0.1 OUTLIER -122.26 138.18 54.59 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.08 -179.217 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.459 ' HA ' ' CB ' ' A' ' 22' ' ' LEU . 54.2 p -176.8 89.26 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.023 0.439 . . . . 0.0 111.062 179.572 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.451 HG22 ' C ' ' A' ' 61' ' ' SER . 0.6 OUTLIER 164.24 73.23 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.027 179.939 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . 0.445 ' H ' HG21 ' A' ' 1' ' ' ILE . 0.6 OUTLIER 63.64 178.39 0.16 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.283 -179.38 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.487 ' CG ' ' O ' ' A' ' 64' ' ' LYS . 0.0 OUTLIER -52.75 90.57 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.406 0.622 . . . . 0.0 110.921 -179.912 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . 0.41 ' N ' ' O ' ' A' ' 63' ' ' ASP . 8.0 p -101.13 -11.48 19.55 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.63 -179.463 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.544 HD21 ' HB2' ' A' ' 7' ' ' ALA . 49.6 t30 -52.96 126.59 43.25 Favored Pre-proline 0 C--N 1.328 -0.36 0 C-N-CA 121.019 -0.272 . . . . 0.0 111.101 -179.229 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -74.04 119.39 5.82 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.526 2.151 . . . . 0.0 112.639 -179.872 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.539 ' HB3' ' HD2' ' A' ' 69' ' ' PRO . 1.7 m80 -69.83 178.51 1.0 Allowed Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.156 -0.474 . . . . 0.0 109.724 179.355 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . 0.539 ' HD2' ' HB3' ' A' ' 68' ' ' HIS . 69.8 Cg_exo -43.17 148.16 0.65 Allowed 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.438 2.092 . . . . 0.0 112.515 -179.979 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.546 ' CB ' ' HB2' ' A' ' 38' ' ' LYS . 0.0 OUTLIER -46.16 135.45 7.71 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.035 0.445 . . . . 0.0 111.257 -179.305 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 . . . . . 0 C--N 1.328 -0.346 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.551 -178.985 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 192' ' ' CYS . . . . . 0.704 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.0 OUTLIER . . . . . 0 CA--C 1.501 -0.932 0 N-CA-C 112.774 0.657 . . . . 0.0 112.774 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 193' ' ' CYS . . . . . 0.704 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.0 OUTLIER -162.63 155.61 16.8 Favored Pre-proline 0 N--CA 1.439 -1.006 0 CA-C-N 114.736 -1.12 . . . . 0.0 112.15 -172.986 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 194' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -98.02 137.58 0.4 Allowed 'Trans proline' 0 N--CA 1.455 -0.778 0 C-N-CA 123.384 2.723 . . . . 0.0 112.981 -179.646 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 67.97 129.77 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 121.114 0.483 . . . . 0.0 111.767 179.044 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 196' ' ' THR . . . . . 0.601 HG22 ' O ' ' B' ' 196' ' ' THR . 52.0 m -160.11 44.48 0.17 Allowed Pre-proline 0 C--N 1.331 -0.235 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.304 179.645 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 197' ' ' PRO . . . . . 0.508 ' CD ' ' N ' ' B' ' 196' ' ' THR . 80.9 Cg_endo -74.93 14.31 0.87 Allowed 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 121.745 1.63 . . . . 0.0 108.919 176.234 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 198' ' ' TYR . . . . . 0.568 ' H ' ' C ' ' B' ' 196' ' ' THR . 59.3 t80 . . . . . 0 C--O 1.248 1.022 0 CA-C-N 113.896 -1.502 . . . . 0.0 111.299 -178.84 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 1' ' ' ILE . . . . . 0.583 ' CG2' ' C ' ' A' ' 62' ' ' THR . 9.7 mm . . . . . 0 N--CA 1.487 1.406 0 CA-C-O 120.817 0.342 . . . . 0.0 111.156 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . 0.465 HG23 ' O ' ' A' ' 1' ' ' ILE . 0.0 OUTLIER 45.01 -171.64 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 CA-C-N 116.155 -0.475 . . . . 0.0 112.231 179.461 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.442 ' O ' ' O ' ' A' ' 4' ' ' HIS . 1.0 OUTLIER -148.09 125.73 11.79 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 116.554 -0.294 . . . . 0.0 110.81 -178.827 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' HIS . . . . . 0.531 ' CG ' ' HB3' ' A' ' 66' ' ' ASN . 4.2 m-70 -37.83 162.95 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 112.073 0.397 . . . . 0.0 112.073 -179.809 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.438 ' OG1' HG23 ' A' ' 6' ' ' THR . 0.2 OUTLIER -137.85 163.36 31.62 Favored 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 112.452 0.538 . . . . 0.0 112.452 -178.354 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.571 ' O ' ' HB3' ' A' ' 7' ' ' ALA . 8.4 p 67.23 -43.34 0.45 Allowed 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 115.378 -0.828 . . . . 0.0 111.674 -179.749 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.571 ' HB3' ' O ' ' A' ' 6' ' ' THR . . . 77.07 -179.76 0.14 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.725 0.298 . . . . 0.0 110.782 -179.678 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.429 ' O ' HG22 ' A' ' 8' ' ' THR . 9.3 m . . . . . 0 C--N 1.332 -0.178 0 CA-C-N 116.466 -0.333 . . . . 0.0 110.552 -179.453 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.474 ' N ' ' CD ' ' A' ' 18' ' ' PRO . 31.2 Cg_exo . . . . . 0 CA--C 1.53 0.324 0 N-CA-C 112.743 0.247 . . . . 0.0 112.743 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.474 ' CD ' ' N ' ' A' ' 17' ' ' PRO . 81.0 Cg_exo -47.56 -63.75 0.3 Allowed 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 122.535 2.157 . . . . 0.0 112.527 -179.891 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -99.43 146.84 18.14 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.186 179.805 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -138.41 29.43 2.43 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.614 0.245 . . . . 0.0 111.199 -179.742 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -141.02 85.39 1.98 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.222 -179.934 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.703 HD12 ' N ' ' A' ' 48' ' ' CYS . 1.4 mt 62.62 123.5 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.574 -0.284 . . . . 0.0 111.537 178.952 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.599 ' HA ' ' HA ' ' A' ' 44' ' ' CYS . 3.8 m -71.8 157.84 37.17 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-O 120.973 0.416 . . . . 0.0 110.788 179.861 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.666 ' HA ' ' HB2' ' A' ' 45' ' ' ALA . 0.8 OUTLIER -65.31 65.3 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.778 -0.646 . . . . 0.0 112.012 -178.97 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.401 ' N ' ' O ' ' A' ' 23' ' ' CYS . 1.1 ttt85 -57.58 82.16 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.906 0.384 . . . . 0.0 110.45 179.215 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.486 ' N ' ' O ' ' A' ' 24' ' ' TYR . 32.8 tttt -85.18 156.59 20.94 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.383 -179.231 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -177.34 100.84 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.764 179.708 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 34.4 t-105 -56.86 -75.27 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.776 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 1.1 m 49.83 81.09 0.06 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.4 179.257 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -62.5 99.38 0.14 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.713 179.737 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . 63.76 -79.55 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.974 -179.75 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -97.32 138.56 34.59 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.601 179.664 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 22.7 m -84.93 -79.08 0.23 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.069 -179.788 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 38.7 t 64.99 -74.76 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.936 -179.904 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.413 ' HA ' ' HE2' ' A' ' 70' ' ' LYS . 1.0 OUTLIER 179.65 29.68 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.09 179.809 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -119.28 -3.16 10.55 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.528 -179.803 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -124.17 54.76 0.72 Allowed Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.57 -0.824 . . . . 0.0 113.307 -179.23 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.469 ' HG2' ' HG3' ' A' ' 70' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 116.719 0.26 . . . . 0.0 111.192 179.625 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . 0.481 ' O ' ' HB2' ' A' ' 44' ' ' CYS . . . . . . . . 0 CA--C 1.521 0.459 0 CA-C-O 120.174 -0.237 . . . . 0.0 113.542 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.599 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 1.7 m 70.77 118.28 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 112.635 0.606 . . . . 0.0 112.635 179.034 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.666 ' HB2' ' HA ' ' A' ' 24' ' ' TYR . . . -122.48 174.29 7.14 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.537 179.614 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.891 ' O ' HG22 ' A' ' 47' ' ' THR . . . -101.76 78.71 1.85 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.479 179.77 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.891 HG22 ' O ' ' A' ' 46' ' ' ALA . 3.5 t 61.79 173.26 0.12 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.637 -0.71 . . . . 0.0 111.507 -179.727 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.703 ' N ' HD12 ' A' ' 22' ' ' LEU . 6.0 m -69.74 -50.77 17.06 Favored Pre-proline 0 C--N 1.331 -0.224 0 CA-C-N 116.089 -0.505 . . . . 0.0 112.287 -179.031 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.609 ' HD2' HG23 ' A' ' 47' ' ' THR . 42.3 Cg_exo -34.1 80.82 0.0 OUTLIER 'Trans proline' 0 C--N 1.353 0.787 0 C-N-CA 122.663 2.242 . . . . 0.0 111.622 179.838 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.676 ' N ' ' O ' ' A' ' 48' ' ' CYS . 3.6 t -161.26 -34.77 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.12 -0.945 . . . . 0.0 111.208 -177.571 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.626 ' CG ' HG22 ' A' ' 58' ' ' THR . 0.1 OUTLIER -43.08 -55.85 3.66 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.83 -179.492 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.454 ' CB ' ' CD ' ' A' ' 53' ' ' PRO . 0.0 OUTLIER -45.99 -65.68 0.63 Allowed Pre-proline 0 C--N 1.331 -0.21 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.074 -179.75 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . 0.454 ' CD ' ' CB ' ' A' ' 52' ' ' LYS . 32.7 Cg_endo -64.58 -154.12 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.088 1.858 . . . . 0.0 110.965 178.916 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.473 0.694 0 CA-C-O 120.954 0.406 . . . . 0.0 110.843 179.671 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.626 HG22 ' CG ' ' A' ' 51' ' ' LYS . 53.0 p . . . . . 0 N--CA 1.465 0.283 0 N-CA-C 112.711 0.634 . . . . 0.0 112.711 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . 0.457 ' HB2' ' HB3' ' A' ' 22' ' ' LEU . 0.8 OUTLIER -179.78 155.94 0.66 Allowed 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.4 -179.373 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.519 ' CB ' ' HB2' ' A' ' 23' ' ' CYS . 0.0 OUTLIER -130.71 4.3 4.57 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 112.06 0.392 . . . . 0.0 112.06 -179.434 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.546 ' CA ' ' HA ' ' A' ' 22' ' ' LEU . 82.4 p 44.63 -162.26 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.241 0 N-CA-C 110.22 -0.289 . . . . 0.0 110.22 -179.17 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.583 ' C ' ' CG2' ' A' ' 1' ' ' ILE . 71.4 p -99.03 123.05 43.06 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 179.291 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 5.1 p30 167.67 179.19 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.908 0.385 . . . . 0.0 111.046 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.4 ' O ' ' ND2' ' A' ' 66' ' ' ASN . 0.0 OUTLIER -80.67 58.67 3.35 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.395 179.52 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . 0.459 ' O ' ' O ' ' A' ' 66' ' ' ASN . 0.6 OUTLIER -59.49 -70.88 0.14 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.613 179.983 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.531 ' HB3' ' CG ' ' A' ' 4' ' ' HIS . 14.2 p30 49.69 161.64 0.04 OUTLIER Pre-proline 0 N--CA 1.463 0.22 0 CA-C-N 115.576 -0.738 . . . . 0.0 112.413 179.761 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 16.9 Cg_exo -68.64 62.16 1.2 Allowed 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 123.193 2.596 . . . . 0.0 112.6 -179.6 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 56.7 p-80 -59.22 109.39 1.87 Allowed Pre-proline 0 C--N 1.328 -0.369 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.702 179.76 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . 0.442 ' HG3' ' HA ' ' B' ' 192' ' ' CYS . 52.4 Cg_exo -53.3 124.72 16.36 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.305 2.003 . . . . 0.0 111.989 -179.917 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.469 ' HG3' ' HG2' ' A' ' 38' ' ' LYS . 0.0 OUTLIER -90.79 -2.99 57.75 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.728 -179.487 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.419 ' HB2' ' CE ' ' A' ' 38' ' ' LYS . 31.7 tt0 . . . . . 0 C--N 1.331 -0.221 0 CA-C-N 116.612 -0.267 . . . . 0.0 111.379 -179.887 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 192' ' ' CYS . . . . . 0.717 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.0 OUTLIER . . . . . 0 CA--C 1.499 -0.999 0 CA-C-O 122.162 0.982 . . . . 0.0 111.87 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 193' ' ' CYS . . . . . 0.717 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.1 OUTLIER 43.93 81.41 0.25 Allowed Pre-proline 0 N--CA 1.441 -0.896 0 CA-C-N 113.114 -1.857 . . . . 0.0 112.6 173.507 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 194' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -83.36 -43.27 0.08 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.552 0 C-N-CA 122.69 2.26 . . . . 0.0 112.213 179.591 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -43.48 98.88 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.498 -179.948 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 196' ' ' THR . . . . . 0.7 ' N ' ' HD3' ' B' ' 197' ' ' PRO . 2.9 p -149.83 45.42 0.36 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.821 179.868 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 197' ' ' PRO . . . . . 0.7 ' HD3' ' N ' ' B' ' 196' ' ' THR . 2.5 Cg_endo -77.17 11.61 2.02 Favored 'Trans proline' 0 N--CA 1.455 -0.773 0 C-N-CA 121.851 1.701 . . . . 0.0 108.537 175.981 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 198' ' ' TYR . . . . . 0.534 ' H ' ' C ' ' B' ' 196' ' ' THR . 10.9 t80 . . . . . 0 C--O 1.249 1.063 0 CA-C-N 113.746 -1.57 . . . . 0.0 111.27 -178.796 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 19.2 mm . . . . . 0 N--CA 1.485 1.278 0 CA-C-O 120.846 0.355 . . . . 0.0 111.132 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.562 HG12 ' HA ' ' A' ' 15' ' ' THR . 27.7 m -136.19 169.78 19.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.99 179.839 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.456 ' H ' HG12 ' A' ' 14' ' ' VAL . 3.2 t -160.31 100.65 1.36 Allowed 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 -179.536 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . 0.779 ' HA ' HG13 ' A' ' 14' ' ' VAL . 3.7 m170 -36.01 120.36 0.62 Allowed 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.48 179.392 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.649 HG23 ' HB2' ' A' ' 12' ' ' SER . 0.8 OUTLIER -84.44 99.86 10.95 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.978 -179.995 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.445 ' CG2' ' N ' ' A' ' 7' ' ' ALA . 0.4 OUTLIER 81.17 -53.97 0.3 Allowed 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.213 179.784 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.489 ' O ' ' N ' ' A' ' 9' ' ' SER . . . 58.98 -96.14 0.06 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.681 -0.236 . . . . 0.0 110.884 -179.688 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.474 ' OG1' ' N ' ' A' ' 9' ' ' SER . 5.3 p 62.01 -68.87 0.06 Allowed 'General case' 0 CA--C 1.529 0.156 0 CA-C-O 120.673 0.273 . . . . 0.0 111.396 179.666 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.489 ' N ' ' O ' ' A' ' 7' ' ' ALA . 0.6 OUTLIER -136.28 -67.02 0.02 OUTLIER Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.997 179.873 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.461 ' HD3' ' CB ' ' A' ' 9' ' ' SER . 97.1 Cg_endo -77.52 -123.88 0.01 OUTLIER 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 122.13 1.887 . . . . 0.0 111.738 179.86 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 18.7 tt 179.77 158.2 0.11 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.105 0 CA-C-O 120.822 0.344 . . . . 0.0 111.053 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.649 ' HB2' HG23 ' A' ' 5' ' ' THR . 0.4 OUTLIER -136.88 -172.26 3.14 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.909 179.881 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.39 91.82 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.755 -179.62 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.779 HG13 ' HA ' ' A' ' 4' ' ' HIS . 0.2 OUTLIER -72.93 -166.54 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.42 179.473 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.562 ' HA ' HG12 ' A' ' 2' ' ' VAL . 1.6 p 75.17 130.32 0.04 OUTLIER 'General case' 0 N--CA 1.462 0.173 0 CA-C-O 121.029 0.442 . . . . 0.0 111.562 179.575 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 41.5 t -113.72 94.31 32.37 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.6 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.467 ' N ' ' HD2' ' A' ' 18' ' ' PRO . 46.2 Cg_exo -55.22 -47.66 25.01 Favored 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.549 2.166 . . . . 0.0 112.691 -179.838 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.467 ' HD2' ' N ' ' A' ' 17' ' ' PRO . 71.8 Cg_endo -78.45 164.77 25.99 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.281 1.987 . . . . 0.0 112.36 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 48.37 87.12 0.01 OUTLIER Glycine 0 C--N 1.33 0.237 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.437 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -87.37 82.14 7.65 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.828 0.347 . . . . 0.0 111.263 -179.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -168.38 -74.49 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.968 179.73 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.958 HD23 ' CB ' ' A' ' 61' ' ' SER . 1.0 OUTLIER -125.45 154.42 42.03 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.018 -179.626 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.602 ' C ' ' H ' ' A' ' 44' ' ' CYS . 2.4 p -109.34 29.15 7.82 Favored 'General case' 0 CA--C 1.534 0.354 0 N-CA-C 112.228 0.455 . . . . 0.0 112.228 -179.172 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.64 ' O ' ' HB2' ' A' ' 60' ' ' CYS . 1.9 m-85 34.82 -159.25 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 122.774 0.43 . . . . 0.0 111.654 179.385 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.603 ' HB3' ' CB ' ' A' ' 41' ' ' GLU . 1.2 mtp180 97.23 117.17 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 122.591 0.356 . . . . 0.0 111.513 179.749 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.751 ' HB2' ' HA ' ' A' ' 57' ' ' VAL . 0.3 OUTLIER -147.98 -93.82 0.08 Allowed 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.236 178.725 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 1.9 mtm 172.15 -164.12 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.255 0 C-N-CA 121.108 -0.237 . . . . 0.0 110.773 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' TRP . . . . . 0.796 ' HB3' HG11 ' A' ' 39' ' ' VAL . 18.1 t-105 -133.18 -84.53 0.46 Allowed 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 116.592 -0.276 . . . . 0.0 111.062 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER 54.53 175.14 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 120.813 0.339 . . . . 0.0 110.726 -179.63 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -86.21 -76.23 0.35 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.983 0.421 . . . . 0.0 110.277 179.456 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -118.1 -130.67 0.3 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.854 179.251 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.468 ' O ' ' N ' ' A' ' 34' ' ' SER . 26.7 p90 -68.47 -35.89 78.19 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 179.121 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER 34.62 -86.19 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 115.345 -0.843 . . . . 0.0 112.771 179.485 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.468 ' N ' ' O ' ' A' ' 32' ' ' PHE . 0.3 OUTLIER 78.32 28.54 0.48 Allowed 'General case' 0 N--CA 1.462 0.173 0 CA-C-O 120.967 0.413 . . . . 0.0 110.338 -179.175 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 1.6 p -152.95 -66.41 0.16 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.621 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -86.45 -155.36 0.25 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.718 179.821 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.713 ' O ' HG22 ' A' ' 39' ' ' VAL . . . 88.91 20.19 47.88 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.711 -0.756 . . . . 0.0 112.49 -179.574 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.454 ' HA ' ' HG3' ' A' ' 70' ' ' LYS . 0.1 OUTLIER -39.38 95.33 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 121.227 0.537 . . . . 0.0 111.629 -179.726 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.796 HG11 ' HB3' ' A' ' 28' ' ' TRP . 30.2 m -145.75 -151.53 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.436 -0.802 . . . . 0.0 109.666 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 1.031 HG13 HG23 ' B' ' 191' ' ' THR . 0.2 OUTLIER -150.03 -171.18 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.11 0 C-N-CA 120.368 -0.533 . . . . 0.0 112.028 -179.995 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.603 ' CB ' ' HB3' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -108.06 155.2 20.65 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.297 -178.629 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.982 HD13 ' CG1' ' A' ' 57' ' ' VAL . 0.5 OUTLIER -64.46 -88.08 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 111.869 0.322 . . . . 0.0 111.869 -179.71 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.459 ' N ' ' HG2' ' A' ' 25' ' ' ARG . . . 126.91 83.94 0.48 Allowed Glycine 0 C--N 1.335 0.518 0 C-N-CA 119.664 -1.255 . . . . 0.0 113.336 179.753 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.602 ' H ' ' C ' ' A' ' 23' ' ' CYS . 0.1 OUTLIER 62.79 144.66 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.17 0.509 . . . . 0.0 112.286 178.819 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.577 ' HB3' ' CE1' ' A' ' 24' ' ' TYR . . . -147.06 -68.78 0.25 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.747 179.33 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.573 ' HB2' ' O ' ' A' ' 45' ' ' ALA . . . 166.14 -37.01 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.666 179.863 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.63 ' HA ' HD12 ' A' ' 22' ' ' LEU . 10.4 t -178.78 173.21 1.27 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.637 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.531 ' N ' ' HD3' ' A' ' 49' ' ' PRO . 22.3 p -142.76 52.81 2.42 Favored Pre-proline 0 C--N 1.331 -0.196 0 N-CA-C 111.995 0.369 . . . . 0.0 111.995 -179.778 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.6 ' HD3' HG23 ' A' ' 47' ' ' THR . 32.3 Cg_exo -57.52 -21.64 47.11 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 121.849 1.699 . . . . 0.0 110.82 178.526 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 3.5 t -61.46 -166.91 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.248 -0.887 . . . . 0.0 111.108 179.689 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 2.0 ptmm? 177.86 39.91 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.706 179.779 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.45 ' HD2' ' O ' ' A' ' 52' ' ' LYS . 0.0 OUTLIER -76.92 154.99 83.05 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.141 -179.924 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -71.19 -89.58 0.0 OUTLIER 'Trans proline' 0 CA--C 1.531 0.365 0 C-N-CA 122.457 2.105 . . . . 0.0 112.184 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -81.08 127.43 32.61 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 120.597 0.237 . . . . 0.0 110.603 179.779 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.514 ' O ' ' HB2' ' A' ' 56' ' ' GLU . 3.1 mm-40 -156.07 -78.61 0.09 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.478 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.516 ' C ' HG12 ' A' ' 57' ' ' VAL . 13.4 tt0 166.34 -28.36 0.0 OUTLIER 'General case' 0 C--N 1.334 -0.089 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.896 -179.663 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.982 ' CG1' HD13 ' A' ' 42' ' ' LEU . 0.3 OUTLIER -167.97 160.03 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.174 0 CA-C-O 121.386 0.612 . . . . 0.0 111.929 179.962 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.48 ' N ' HG23 ' A' ' 57' ' ' VAL . 0.2 OUTLIER -122.84 -67.42 0.95 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 114.957 -1.02 . . . . 0.0 109.967 179.192 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . 0.825 ' CB ' HD13 ' A' ' 22' ' ' LEU . 1.3 p 178.73 146.88 0.17 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.552 179.425 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.64 ' HB2' ' O ' ' A' ' 24' ' ' TYR . 11.9 m -133.96 84.68 2.14 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.462 -179.256 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.958 ' CB ' HD23 ' A' ' 22' ' ' LEU . 2.1 t -93.58 74.75 4.4 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.91 0.386 . . . . 0.0 110.832 179.879 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.417 HG22 ' H ' ' A' ' 63' ' ' ASP . 0.2 OUTLIER -157.95 -164.28 1.49 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.7 -179.999 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . 0.417 ' H ' HG22 ' A' ' 62' ' ' THR . 10.8 p-10 -124.61 28.25 6.63 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.197 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.412 ' HA ' ' CE1' ' A' ' 4' ' ' HIS . 0.6 OUTLIER 179.54 43.81 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.05 0.452 . . . . 0.0 110.776 179.776 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 13.5 t -77.79 -27.23 50.15 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.084 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -58.52 105.32 0.52 Allowed Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.456 -179.65 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 7.1 Cg_exo -73.51 -156.16 0.05 OUTLIER 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.757 2.305 . . . . 0.0 111.908 179.576 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.423 ' CB ' ' HD2' ' A' ' 69' ' ' PRO . 0.7 OUTLIER -106.77 166.59 10.85 Favored Pre-proline 0 C--N 1.331 -0.211 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.818 179.831 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.423 ' HD2' ' CB ' ' A' ' 68' ' ' HIS . 9.9 Cg_endo -53.47 177.33 0.07 OUTLIER 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.619 2.212 . . . . 0.0 112.528 -179.845 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.454 ' HG3' ' HA ' ' A' ' 38' ' ' LYS . 3.0 mmpt? -85.11 -56.48 3.53 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.351 -179.623 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 31.7 mt-30 -42.74 -65.21 0.5 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.446 -179.682 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -122.34 88.73 49.0 Favored Pre-proline 0 C--N 1.33 -0.255 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.821 179.76 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -75.42 -44.44 0.31 Allowed 'Trans proline' 0 C--N 1.343 0.287 0 C-N-CA 122.576 2.184 . . . . 0.0 112.387 -179.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.094 0 CA-C-O 118.367 -1.241 . . . . 0.0 112.426 -179.968 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 181' ' ' TYR . . . . . . . . . . . . . 24.0 m-85 . . . . . 0 N--CA 1.487 1.41 0 CA-C-O 120.814 0.34 . . . . 0.0 111.157 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 182' ' ' ARG . . . . . . . . . . . . . 7.5 tpp180 -99.76 133.28 44.34 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.942 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 183' ' ' GLY . . . . . . . . . . . . . . . -145.67 -46.18 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.586 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 184' ' ' TRP . . . . . 0.416 ' HA ' ' CE3' ' B' ' 184' ' ' TRP . 4.2 m95 59.74 23.13 11.99 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.785 0.326 . . . . 0.0 110.989 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 185' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -47.56 158.43 0.19 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.251 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 186' ' ' HIS . . . . . . . . . . . . . 2.5 t-160 -89.27 126.97 35.73 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.958 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 187' ' ' TRP . . . . . 0.424 ' HD1' HG23 ' B' ' 188' ' ' VAL . 0.0 OUTLIER -47.24 -89.53 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.924 179.933 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 188' ' ' VAL . . . . . 0.591 ' HB ' HG12 ' A' ' 39' ' ' VAL . 0.2 OUTLIER -79.83 -171.48 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.67 0.271 . . . . 0.0 110.469 179.587 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 189' ' ' TYR . . . . . 0.502 ' H ' HG12 ' B' ' 188' ' ' VAL . 0.0 OUTLIER -100.63 -165.75 1.24 Allowed 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 116.575 -0.284 . . . . 0.0 110.504 -179.822 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 190' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -146.02 145.76 30.72 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.817 0.342 . . . . 0.0 111.046 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 191' ' ' THR . . . . . 1.031 HG23 HG13 ' A' ' 40' ' ' VAL . 0.2 OUTLIER -89.62 -76.27 0.42 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.253 -179.708 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 192' ' ' CYS . . . . . 0.702 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.0 OUTLIER -42.93 170.27 0.0 OUTLIER 'General case' 0 CA--C 1.499 -0.988 0 CA-C-O 122.06 0.933 . . . . 0.0 112.101 -179.738 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 193' ' ' CYS . . . . . 0.702 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.1 OUTLIER 41.09 68.6 2.37 Favored Pre-proline 0 C--N 1.314 -0.948 0 CA-C-N 113.149 -1.842 . . . . 0.0 112.209 173.817 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 194' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -73.1 -70.72 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.845 2.363 . . . . 0.0 112.422 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 166.56 -20.69 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.465 -179.907 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 196' ' ' THR . . . . . 0.756 ' C ' ' H ' ' B' ' 198' ' ' TYR . 0.6 OUTLIER -79.36 -20.84 0.33 Allowed Pre-proline 0 C--N 1.331 -0.198 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -179.744 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 197' ' ' PRO . . . . . 0.685 ' CD ' ' N ' ' B' ' 196' ' ' THR . 17.8 Cg_exo -64.26 25.13 0.07 OUTLIER 'Trans proline' 0 C--N 1.353 0.815 0 C-N-CA 121.218 1.279 . . . . 0.0 109.575 176.733 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 198' ' ' TYR . . . . . 0.756 ' H ' ' C ' ' B' ' 196' ' ' THR . 5.6 t80 . . . . . 0 C--O 1.248 1.022 0 CA-C-N 114.372 -1.285 . . . . 0.0 111.346 -178.74 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . 0.654 ' N ' HD13 ' A' ' 1' ' ' ILE . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.375 0 CA-C-O 120.989 0.423 . . . . 0.0 111.131 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.424 HG12 ' HA ' ' A' ' 15' ' ' THR . 9.9 m -132.38 -179.56 3.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.351 179.496 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.545 ' N ' HG23 ' A' ' 14' ' ' VAL . 7.9 t -135.16 118.09 16.29 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.594 -0.442 . . . . 0.0 112.114 -179.927 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . 0.562 ' CA ' ' HB ' ' A' ' 14' ' ' VAL . 1.3 m-70 -35.07 143.55 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.343 179.356 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.445 ' OG1' ' HB ' ' A' ' 11' ' ' ILE . 0.2 OUTLIER -57.34 -164.23 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.47 -179.306 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.445 ' H ' HG22 ' A' ' 5' ' ' THR . 13.9 t -90.6 42.64 1.11 Allowed 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 112.295 0.479 . . . . 0.0 112.295 -178.778 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 1.027 ' HB3' ' CG2' ' A' ' 11' ' ' ILE . . . -150.52 -178.6 6.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.53 0.205 . . . . 0.0 111.003 179.312 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.945 HG23 ' HD3' ' A' ' 10' ' ' PRO . 0.5 OUTLIER -58.46 -109.44 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 116.687 -0.233 . . . . 0.0 110.966 -179.521 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.644 ' N ' ' CD ' ' A' ' 10' ' ' PRO . 81.6 p -122.92 0.86 0.06 OUTLIER Pre-proline 0 CA--C 1.545 0.772 0 N-CA-C 114.791 1.404 . . . . 0.0 114.791 -178.951 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.945 ' HD3' HG23 ' A' ' 8' ' ' THR . 77.4 Cg_endo -78.74 -23.28 8.32 Favored 'Trans proline' 0 C--N 1.355 0.877 0 C-N-CA 121.549 1.5 . . . . 0.0 111.98 179.878 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 1.027 ' CG2' ' HB3' ' A' ' 7' ' ' ALA . 0.1 OUTLIER -53.18 -163.96 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.625 -0.716 . . . . 0.0 112.068 -179.38 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.4 t -173.33 -36.56 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.859 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.27 66.46 0.11 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.796 179.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.562 ' HB ' ' CA ' ' A' ' 4' ' ' HIS . 0.5 OUTLIER -112.83 135.51 52.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.764 -179.761 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.621 ' OG1' ' CD ' ' A' ' 17' ' ' PRO . 1.7 t 157.11 125.61 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 116.007 -0.542 . . . . 0.0 109.607 -179.177 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.632 ' N ' ' CD ' ' A' ' 17' ' ' PRO . 0.5 OUTLIER -117.59 26.21 0.11 Allowed Pre-proline 0 CA--C 1.542 0.669 0 N-CA-C 113.757 1.021 . . . . 0.0 113.757 -178.364 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.632 ' CD ' ' N ' ' A' ' 16' ' ' CYS . 77.9 Cg_exo -46.07 -49.78 10.83 Favored 'Trans proline' 0 C--N 1.349 0.572 0 C-N-CA 122.416 2.077 . . . . 0.0 113.461 179.615 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.628 ' HD2' ' N ' ' A' ' 17' ' ' PRO . 5.7 Cg_endo -48.97 -177.49 0.01 OUTLIER 'Trans proline' 0 C--N 1.351 0.685 0 C-N-CA 122.527 2.152 . . . . 0.0 112.766 -179.209 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.406 ' O ' ' CB ' ' A' ' 20' ' ' GLU . . . -42.25 91.03 0.01 OUTLIER Glycine 0 C--N 1.334 0.452 0 CA-C-N 116.0 -0.546 . . . . 0.0 113.164 -179.606 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.439 ' N ' ' O ' ' A' ' 18' ' ' PRO . 1.6 mt-10 162.95 -173.46 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 122.595 0.358 . . . . 0.0 110.2 -179.87 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 8.1 m-20 -178.94 -79.47 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.806 0.336 . . . . 0.0 111.194 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.703 HD21 ' N ' ' A' ' 60' ' ' CYS . 3.5 tm? -59.05 91.72 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.316 -179.725 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.547 ' HA ' ' HA ' ' A' ' 44' ' ' CYS . 4.6 t -66.02 63.06 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 120.738 0.304 . . . . 0.0 111.272 179.828 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.526 ' N ' HD13 ' A' ' 22' ' ' LEU . 6.7 p90 -47.88 145.27 3.0 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.019 0.438 . . . . 0.0 111.933 -179.62 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.579 ' HD3' HG23 ' A' ' 40' ' ' VAL . 0.0 OUTLIER -138.26 137.76 37.8 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.485 179.744 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -78.25 150.48 33.4 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.955 -179.886 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . 0.432 ' O ' ' N ' ' A' ' 29' ' ' CYS . 14.7 ptm -143.54 79.29 1.63 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.976 179.885 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' TRP . . . . . 0.759 ' HB2' HG11 ' A' ' 39' ' ' VAL . 69.2 t-105 -58.63 79.77 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.341 -179.831 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . 0.432 ' N ' ' O ' ' A' ' 27' ' ' MET . 0.5 OUTLIER -170.02 119.02 0.6 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.074 179.762 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.79 -162.01 0.59 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.77 179.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -56.37 -38.13 71.01 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.328 -179.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 27.3 m-85 -102.96 -79.17 0.53 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.921 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.477 ' O ' ' N ' ' A' ' 35' ' ' SER . 19.5 p 38.22 30.77 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 112.208 0.447 . . . . 0.0 112.208 179.773 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.3 m 48.46 -86.9 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 116.594 -0.276 . . . . 0.0 111.392 -179.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.477 ' N ' ' O ' ' A' ' 33' ' ' CYS . 97.6 p -176.49 71.23 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.787 0.327 . . . . 0.0 110.841 179.803 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 20.8 mtt180 -115.05 -87.93 0.58 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.1 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.412 ' HA2' ' O ' ' A' ' 28' ' ' TRP . . . 51.6 23.32 9.63 Favored Glycine 0 C--N 1.334 0.431 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.996 179.883 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.852 ' HE2' HG11 ' B' ' 188' ' ' VAL . 0.0 OUTLIER -82.31 51.14 1.75 Allowed 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 -179.422 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.759 HG11 ' HB2' ' A' ' 28' ' ' TRP . 3.2 p -135.41 12.39 1.05 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 CA-C-O 120.683 0.277 . . . . 0.0 110.993 179.089 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.758 HG13 ' OG1' ' B' ' 191' ' ' THR . 12.5 p -47.57 153.37 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.334 -0.107 0 CA-C-O 121.185 0.517 . . . . 0.0 112.185 -179.101 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.413 ' N ' HG22 ' A' ' 40' ' ' VAL . 0.0 OUTLIER -174.68 131.32 0.34 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.282 179.819 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.471 HD23 ' N ' ' A' ' 42' ' ' LEU . 2.4 pt? -50.22 176.6 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.367 -179.503 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.495 ' HA3' ' CE1' ' A' ' 24' ' ' TYR . . . -159.69 -68.97 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.316 -0.945 . . . . 0.0 113.522 -179.529 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.547 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 0.0 OUTLIER 70.41 99.53 0.06 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.239 0.543 . . . . 0.0 111.277 -179.263 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -128.4 -139.49 0.24 Allowed 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 115.342 -0.845 . . . . 0.0 110.09 179.747 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -167.98 36.53 0.03 OUTLIER 'General case' 0 C--N 1.334 -0.1 0 O-C-N 122.253 -0.28 . . . . 0.0 111.658 179.772 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 6.8 t -176.81 40.89 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 120.99 -0.284 . . . . 0.0 111.718 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 63.5 m 39.24 73.23 0.83 Allowed Pre-proline 0 N--CA 1.466 0.355 0 CA-C-N 116.731 -0.213 . . . . 0.0 111.538 179.712 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.44 ' HG2' ' HB2' ' A' ' 24' ' ' TYR . 10.6 Cg_endo -53.14 -19.08 11.32 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.128 1.886 . . . . 0.0 110.847 178.601 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.439 ' HB2' ' HA ' ' A' ' 58' ' ' THR . 39.5 t -38.24 -74.19 0.04 OUTLIER 'General case' 0 N--CA 1.457 -0.088 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.983 179.347 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 23.3 mmtt 67.89 -161.87 0.21 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.581 -179.705 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.599 ' CB ' ' CD ' ' A' ' 53' ' ' PRO . 9.5 mmmt -96.6 -163.72 0.05 OUTLIER Pre-proline 0 CA--C 1.539 0.533 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.617 -179.522 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . 0.599 ' CD ' ' CB ' ' A' ' 52' ' ' LYS . 35.5 Cg_exo -39.98 -28.3 0.25 Allowed 'Trans proline' 0 C--N 1.356 0.945 0 C-N-CA 122.644 2.229 . . . . 0.0 114.484 -178.587 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . 0.456 ' CZ ' ' HB2' ' A' ' 52' ' ' LYS . 0.1 OUTLIER -50.16 -25.45 3.57 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 120.556 -0.458 . . . . 0.0 111.422 -179.723 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -135.92 -170.65 2.68 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.936 0.398 . . . . 0.0 111.033 179.526 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.407 ' HG2' ' O ' ' A' ' 27' ' ' MET . 0.4 OUTLIER -126.01 -30.77 2.93 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.964 -179.924 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.519 HG12 ' H ' ' A' ' 58' ' ' THR . 1.4 t -44.1 167.74 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.334 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.964 -179.422 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.519 ' H ' HG12 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -146.12 127.91 15.33 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.412 179.855 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . 0.457 ' HA ' HD11 ' A' ' 22' ' ' LEU . 1.6 t -50.63 105.79 0.11 Allowed 'General case' 0 C--O 1.232 0.183 0 CA-C-O 121.025 0.44 . . . . 0.0 110.239 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.703 ' N ' HD21 ' A' ' 22' ' ' LEU . 0.5 OUTLIER -78.31 -97.04 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 115.902 -0.59 . . . . 0.0 112.315 -178.522 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.502 ' N ' HD22 ' A' ' 22' ' ' LEU . 13.1 t 39.1 88.18 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 111.608 0.225 . . . . 0.0 111.608 -179.516 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.513 HG23 ' H ' ' A' ' 63' ' ' ASP . 0.7 OUTLIER 175.75 -59.49 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 111.791 0.293 . . . . 0.0 111.791 179.983 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . 0.513 ' H ' HG23 ' A' ' 62' ' ' THR . 8.6 m-20 -130.76 -158.8 0.92 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.784 0.326 . . . . 0.0 111.381 -179.251 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.455 ' CB ' ' CD2' ' A' ' 4' ' ' HIS . 0.7 OUTLIER -77.49 -2.43 35.44 Favored 'General case' 0 N--CA 1.461 0.124 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.975 -179.467 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 56.1 m 36.02 42.26 0.16 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.952 -0.567 . . . . 0.0 112.354 179.39 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.405 ' N ' ' HD3' ' A' ' 67' ' ' PRO . 2.3 m-80 -133.4 53.03 9.5 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 120.695 0.283 . . . . 0.0 111.491 179.965 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . 0.405 ' HD3' ' N ' ' A' ' 66' ' ' ASN . 96.1 Cg_endo -79.81 -167.55 0.52 Allowed 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.534 2.156 . . . . 0.0 112.184 179.532 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 41.8 m80 -68.97 112.1 10.49 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.671 179.802 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.754 ' HB3' HG12 ' A' ' 40' ' ' VAL . 37.3 Cg_exo -60.9 -67.14 0.05 OUTLIER 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.476 2.117 . . . . 0.0 112.517 -179.536 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.565 ' HG3' ' CB ' ' A' ' 38' ' ' LYS . 1.0 OUTLIER -73.76 145.97 44.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.011 0.434 . . . . 0.0 111.087 -179.71 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -96.35 38.44 1.2 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.212 -179.715 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.4 ' HB3' ' HD2' ' A' ' 73' ' ' PRO . 0.8 OUTLIER 58.12 164.84 0.08 OUTLIER Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.898 179.887 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.4 ' HD2' ' HB3' ' A' ' 72' ' ' ARG . 50.8 Cg_exo -54.27 120.87 8.69 Favored 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.598 2.199 . . . . 0.0 112.31 -179.885 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.392 -1.227 . . . . 0.0 112.47 179.978 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 181' ' ' TYR . . . . . . . . . . . . . 83.1 t80 . . . . . 0 N--CA 1.486 1.364 0 CA-C-O 120.868 0.366 . . . . 0.0 111.177 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 182' ' ' ARG . . . . . . . . . . . . . 16.1 mtp85 -60.01 -67.84 0.35 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.813 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 183' ' ' GLY . . . . . 0.489 ' O ' ' CG ' ' B' ' 184' ' ' TRP . . . 57.81 163.93 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.775 179.793 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 184' ' ' TRP . . . . . 0.489 ' CG ' ' O ' ' B' ' 183' ' ' GLY . 2.4 p90 51.76 169.86 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.181 0.515 . . . . 0.0 111.87 179.885 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 185' ' ' LYS . . . . . . . . . . . . . 2.0 ptmt 171.59 -41.76 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.406 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 186' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -128.23 86.87 2.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.431 179.6 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 187' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -51.6 -84.88 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.681 -179.372 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 188' ' ' VAL . . . . . 0.852 HG11 ' HE2' ' A' ' 38' ' ' LYS . 2.8 p -95.93 143.05 12.83 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.411 0 CA-C-O 120.934 0.397 . . . . 0.0 111.476 -179.259 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 189' ' ' TYR . . . . . 0.681 ' CE2' HG22 ' A' ' 39' ' ' VAL . 13.4 p90 -106.86 103.49 12.93 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.762 -179.501 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 190' ' ' TYR . . . . . 0.409 ' HB3' ' O ' ' A' ' 38' ' ' LYS . 0.3 OUTLIER -95.82 161.13 14.14 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.735 179.284 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 191' ' ' THR . . . . . 0.758 ' OG1' HG13 ' A' ' 40' ' ' VAL . 91.1 m -80.35 -2.5 45.71 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.318 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 192' ' ' CYS . . . . . 0.685 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.0 OUTLIER -88.62 169.24 11.87 Favored 'General case' 0 CA--C 1.498 -1.034 0 CA-C-O 122.132 0.968 . . . . 0.0 111.399 179.816 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 193' ' ' CYS . . . . . 0.686 ' N ' ' HD3' ' B' ' 194' ' ' PRO . 0.1 OUTLIER 38.61 48.09 1.5 Allowed Pre-proline 0 C--N 1.314 -0.942 0 CA-C-N 112.995 -1.911 . . . . 0.0 112.843 174.12 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 194' ' ' PRO . . . . . 0.686 ' HD3' ' N ' ' B' ' 193' ' ' CYS . 57.3 Cg_endo -100.67 -69.6 0.0 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.966 0 C-N-CA 123.602 2.868 . . . . 0.0 112.838 -179.452 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -70.46 -84.75 0.03 OUTLIER 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.153 -0.476 . . . . 0.0 112.012 -179.131 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 196' ' ' THR . . . . . 0.629 ' C ' ' H ' ' B' ' 198' ' ' TYR . 10.2 t -160.17 52.04 0.43 Allowed Pre-proline 0 C--N 1.332 -0.16 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 -179.089 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 197' ' ' PRO . . . . . 0.6 ' HD3' ' N ' ' B' ' 196' ' ' THR . 2.6 Cg_exo -73.08 15.89 0.46 Allowed 'Trans proline' 0 N--CA 1.459 -0.514 0 C-N-CA 121.879 1.72 . . . . 0.0 108.73 175.848 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 198' ' ' TYR . . . . . 0.629 ' H ' ' C ' ' B' ' 196' ' ' THR . 51.4 t80 . . . . . 0 C--O 1.25 1.079 0 CA-C-N 113.939 -1.482 . . . . 0.0 111.176 -178.6 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 24.5 mm . . . . . 0 N--CA 1.486 1.355 0 CA-C-O 120.789 0.328 . . . . 0.0 111.068 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.706 HG21 HG22 ' A' ' 15' ' ' THR . 0.5 OUTLIER -155.0 -176.18 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.901 179.872 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.591 ' H ' HG22 ' A' ' 2' ' ' VAL . 21.6 m -103.45 -174.63 2.59 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.147 0.499 . . . . 0.0 111.561 -179.537 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . 0.5 ' O ' ' CD2' ' A' ' 4' ' ' HIS . 4.3 t60 -139.53 97.59 3.31 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.925 179.307 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.435 HG21 ' CA ' ' A' ' 11' ' ' ILE . 1.1 m 28.63 36.78 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 114.673 -1.149 . . . . 0.0 112.71 -179.736 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.546 ' O ' HG22 ' A' ' 6' ' ' THR . 21.0 m 48.94 21.67 0.49 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.604 0.24 . . . . 0.0 111.624 -179.813 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 44.61 30.07 0.48 Allowed 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 120.756 0.313 . . . . 0.0 111.51 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.671 HG23 ' HB ' ' B' ' 191' ' ' THR . 30.2 m -121.89 -70.88 0.76 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.864 -179.824 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.416 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.3 OUTLIER -75.81 165.91 49.43 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.626 179.831 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.44 ' C ' HD13 ' A' ' 11' ' ' ILE . 6.3 Cg_endo -48.57 -73.73 0.04 OUTLIER 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.753 2.302 . . . . 0.0 112.103 179.884 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.44 HD13 ' C ' ' A' ' 10' ' ' PRO . 0.0 OUTLIER -150.1 146.43 16.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.829 179.609 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -170.2 154.16 4.82 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.87 -179.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -77.5 62.0 2.38 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.038 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.426 HG11 ' H ' ' A' ' 6' ' ' THR . 0.0 OUTLIER -40.58 -83.23 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.385 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.621 -179.802 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.706 HG22 HG21 ' A' ' 2' ' ' VAL . 31.0 p 47.57 89.4 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 120.795 0.331 . . . . 0.0 111.109 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 10.0 t -59.44 136.05 88.94 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.022 -179.862 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -52.89 168.2 0.53 Allowed 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.433 2.089 . . . . 0.0 112.297 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -63.58 161.21 32.66 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.509 2.139 . . . . 0.0 112.214 179.884 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 46.78 70.85 0.61 Allowed Glycine 0 CA--C 1.518 0.23 0 C-N-CA 120.957 -0.639 . . . . 0.0 112.66 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -151.2 -177.28 5.95 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.894 0.378 . . . . 0.0 111.046 -179.785 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.671 ' HB3' ' HB3' ' A' ' 45' ' ' ALA . 0.8 OUTLIER -107.25 69.59 0.76 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.959 -179.954 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.466 ' HB3' ' H ' ' A' ' 23' ' ' CYS . 0.2 OUTLIER 49.88 -96.41 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.795 -0.639 . . . . 0.0 112.256 179.585 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.602 ' C ' ' H ' ' A' ' 44' ' ' CYS . 0.9 OUTLIER -158.66 30.76 0.23 Allowed 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 113.268 0.84 . . . . 0.0 113.268 -178.485 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.574 ' HB3' ' HA ' ' A' ' 42' ' ' LEU . 0.1 OUTLIER 55.07 161.21 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 118.2 0.454 . . . . 0.0 110.788 178.624 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.772 ' HA ' HD22 ' A' ' 42' ' ' LEU . 0.8 OUTLIER -150.93 63.32 0.92 Allowed 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.503 0.557 . . . . 0.0 112.503 179.841 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.678 ' HD2' HG11 ' A' ' 57' ' ' VAL . 0.5 OUTLIER -51.02 132.93 27.69 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.087 0.47 . . . . 0.0 111.62 179.853 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 2.7 ptp -152.96 110.34 3.53 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.342 179.578 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' TRP . . . . . 0.673 ' HB2' HG11 ' A' ' 39' ' ' VAL . 26.4 t90 -79.89 -78.77 0.16 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.583 -179.314 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . 0.443 ' O ' ' O ' ' A' ' 30' ' ' ASP . 2.4 t 52.62 -89.98 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.303 -178.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.443 ' O ' ' O ' ' A' ' 29' ' ' CYS . 82.9 m-20 44.93 -177.31 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 120.953 0.406 . . . . 0.0 111.894 179.223 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . 39.45 -145.72 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.405 179.757 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -92.49 44.72 1.17 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.872 0.367 . . . . 0.0 110.889 179.707 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 6.2 p -55.66 125.49 21.37 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.796 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 2.8 m -48.22 -52.94 18.78 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.513 -179.679 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.428 ' CB ' ' HB2' ' A' ' 70' ' ' LYS . 1.3 m -137.79 166.96 22.72 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.041 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 2.5 mtm-85 -89.32 108.66 19.75 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.899 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.402 ' N ' ' HB3' ' A' ' 70' ' ' LYS . . . 163.46 -163.54 35.69 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.404 -0.903 . . . . 0.0 112.579 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.436 ' HB2' ' HG2' ' A' ' 70' ' ' LYS . 0.0 OUTLIER 56.58 168.69 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.686 0.279 . . . . 0.0 110.702 -179.816 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.673 HG11 ' HB2' ' A' ' 28' ' ' TRP . 18.3 t 62.88 27.65 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 121.024 0.44 . . . . 0.0 110.232 -179.029 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 33.7 m -67.54 -177.43 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.762 -179.463 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 177.61 -63.34 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.52 179.882 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.772 HD22 ' HA ' ' A' ' 25' ' ' ARG . 0.4 OUTLIER 56.59 169.57 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.95 179.788 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 152.9 36.64 0.03 OUTLIER Glycine 0 CA--C 1.523 0.555 0 C-N-CA 119.985 -1.102 . . . . 0.0 114.358 179.58 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.602 ' H ' ' C ' ' A' ' 23' ' ' CYS . 87.6 m 58.69 114.93 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 117.128 0.464 . . . . 0.0 111.611 179.122 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.671 ' HB3' ' HB3' ' A' ' 21' ' ' ASN . . . -85.84 169.65 13.14 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.964 179.639 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -110.34 -39.28 5.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.821 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.702 HG23 ' CD ' ' A' ' 49' ' ' PRO . 11.7 t -138.53 164.3 29.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.112 179.724 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.615 ' N ' ' HD3' ' A' ' 49' ' ' PRO . 0.9 OUTLIER -132.59 44.45 1.33 Allowed Pre-proline 0 CA--C 1.532 0.254 0 N-CA-C 112.762 0.652 . . . . 0.0 112.762 -179.077 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.702 ' CD ' HG23 ' A' ' 47' ' ' THR . 55.4 Cg_endo -91.43 18.38 1.22 Allowed 'Trans proline' 0 N--CA 1.455 -0.789 0 C-N-CA 122.517 2.144 . . . . 0.0 110.518 177.817 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.462 ' O ' ' CD ' ' A' ' 52' ' ' LYS . 9.8 t -105.71 -112.99 0.26 Allowed 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 115.283 -0.871 . . . . 0.0 111.427 -178.412 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.436 ' CG ' ' O ' ' A' ' 50' ' ' SER . 0.6 OUTLIER 51.99 24.94 2.85 Favored 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 122.437 0.295 . . . . 0.0 111.681 -179.847 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.711 ' HB2' ' HD3' ' A' ' 53' ' ' PRO . 0.3 OUTLIER -143.3 -54.19 0.02 OUTLIER Pre-proline 0 CA--C 1.533 0.301 0 N-CA-C 111.935 0.346 . . . . 0.0 111.935 179.527 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . 0.711 ' HD3' ' HB2' ' A' ' 52' ' ' LYS . 15.3 Cg_exo -69.3 153.62 70.76 Favored 'Trans proline' 0 C--N 1.35 0.639 0 C-N-CA 122.253 1.969 . . . . 0.0 112.565 -179.633 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -77.14 75.29 3.71 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.505 179.777 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -105.71 -67.95 0.9 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.01 -179.49 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 173.55 -36.64 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.621 -179.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.884 HG13 ' H ' ' A' ' 58' ' ' THR . 2.4 p 179.69 -100.45 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.404 0 CA-C-N 115.949 -0.568 . . . . 0.0 111.491 179.697 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.884 ' H ' HG13 ' A' ' 57' ' ' VAL . 0.2 OUTLIER 85.98 31.17 0.04 OUTLIER 'General case' 0 CA--C 1.52 -0.186 0 C-N-CA 123.285 0.634 . . . . 0.0 110.902 -179.455 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . 0.829 ' H ' HG22 ' A' ' 57' ' ' VAL . 15.4 m -167.94 158.51 10.65 Favored 'General case' 0 CA--C 1.528 0.117 0 CA-C-O 121.741 0.781 . . . . 0.0 112.814 179.716 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.44 ' O ' ' HB2' ' A' ' 22' ' ' LEU . 0.2 OUTLIER 170.47 129.35 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 114.241 -1.345 . . . . 0.0 109.159 178.646 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.456 ' HA ' ' CG ' ' A' ' 22' ' ' LEU . 16.1 p -176.78 170.55 2.34 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.916 0.388 . . . . 0.0 111.336 -179.238 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER 48.73 38.2 11.2 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.45 179.803 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 179.01 -174.64 0.19 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.769 179.813 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.512 ' HE3' HG12 ' A' ' 2' ' ' VAL . 12.8 mmtm -101.91 17.99 21.73 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.221 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . 0.417 ' HB2' ' O ' ' A' ' 64' ' ' LYS . 56.3 m 68.25 -49.62 0.55 Allowed 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 112.361 0.504 . . . . 0.0 112.361 179.499 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.44 ' ND2' ' HB2' ' A' ' 64' ' ' LYS . 10.3 p30 -32.53 98.18 0.12 Allowed Pre-proline 0 N--CA 1.469 0.522 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 -179.728 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -83.72 -101.73 0.0 OUTLIER 'Trans proline' 0 CA--C 1.536 0.598 0 C-N-CA 122.708 2.272 . . . . 0.0 112.348 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.418 ' CE1' ' HA2' ' A' ' 74' ' ' GLY . 1.8 t-80 175.47 132.08 0.15 Allowed Pre-proline 0 CA--C 1.531 0.228 0 O-C-N 122.343 -0.223 . . . . 0.0 110.875 179.836 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 68' ' ' HIS . 33.6 Cg_exo -59.97 155.22 45.62 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.511 2.141 . . . . 0.0 112.41 179.9 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.436 ' HG2' ' HB2' ' A' ' 38' ' ' LYS . 0.0 OUTLIER -97.5 -34.31 11.05 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.754 179.609 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -51.69 -62.04 1.88 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.904 0.383 . . . . 0.0 110.725 179.725 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.441 ' HB3' ' HD2' ' A' ' 73' ' ' PRO . 3.2 mmp_? -63.16 163.81 16.26 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.655 179.695 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.441 ' HD2' ' HB3' ' A' ' 72' ' ' ARG . 87.7 Cg_exo -44.24 -51.96 6.24 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.577 2.185 . . . . 0.0 112.541 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . 0.418 ' HA2' ' CE1' ' A' ' 68' ' ' HIS . . . . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.308 -1.273 . . . . 0.0 112.622 179.762 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 181' ' ' TYR . . . . . 0.44 ' O ' ' N ' ' B' ' 183' ' ' GLY . 0.4 OUTLIER . . . . . 0 N--CA 1.486 1.374 0 CA-C-O 120.705 0.288 . . . . 0.0 111.132 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 182' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 44.23 -90.11 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.446 -179.925 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 183' ' ' GLY . . . . . 0.44 ' N ' ' O ' ' B' ' 181' ' ' TYR . . . 84.71 11.76 76.44 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.626 -0.797 . . . . 0.0 112.8 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 184' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -67.02 -168.24 0.07 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.75 0.309 . . . . 0.0 110.766 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 185' ' ' LYS . . . . . . . . . . . . . 21.5 tptp -71.68 151.5 43.6 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.983 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 186' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -149.81 -163.87 1.89 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.592 179.896 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 187' ' ' TRP . . . . . 0.446 ' HB2' ' CE2' ' B' ' 190' ' ' TYR . 33.3 p90 -48.45 161.98 0.11 Allowed 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.771 0.32 . . . . 0.0 110.998 179.913 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 188' ' ' VAL . . . . . 0.436 ' HB ' ' H ' ' B' ' 189' ' ' TYR . 0.2 OUTLIER -85.18 -94.03 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.137 -179.717 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 189' ' ' TYR . . . . . 0.436 ' H ' ' HB ' ' B' ' 188' ' ' VAL . 0.4 OUTLIER -160.67 113.48 2.0 Favored 'General case' 0 N--CA 1.455 -0.199 0 O-C-N 122.161 -0.337 . . . . 0.0 111.113 -179.787 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 190' ' ' TYR . . . . . 0.446 ' CE2' ' HB2' ' B' ' 187' ' ' TRP . 1.2 m-85 -120.19 85.21 2.35 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.903 0.382 . . . . 0.0 110.769 179.606 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 191' ' ' THR . . . . . 0.671 ' HB ' HG23 ' A' ' 8' ' ' THR . 21.7 p -90.38 -10.63 43.23 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.327 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 192' ' ' CYS . . . . . 0.698 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.0 OUTLIER -46.26 172.49 0.01 OUTLIER 'General case' 0 CA--C 1.499 -1.009 0 CA-C-O 121.629 0.728 . . . . 0.0 111.559 -179.957 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 193' ' ' CYS . . . . . 0.698 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.0 OUTLIER 46.96 112.95 0.0 OUTLIER Pre-proline 0 C--N 1.315 -0.933 0 CA-C-N 113.552 -1.658 . . . . 0.0 112.512 173.636 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 194' ' ' PRO . . . . . . . . . . . . . 80.3 Cg_exo -42.22 162.88 0.04 OUTLIER 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.709 2.273 . . . . 0.0 112.622 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -94.34 -15.23 24.58 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.792 -179.45 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 196' ' ' THR . . . . . 0.551 ' C ' ' H ' ' B' ' 198' ' ' TYR . 27.3 p -122.02 40.3 0.44 Allowed Pre-proline 0 C--N 1.331 -0.235 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 197' ' ' PRO . . . . . 0.544 ' CD ' ' N ' ' B' ' 196' ' ' THR . 94.2 Cg_endo -76.25 15.39 0.99 Allowed 'Trans proline' 0 N--CA 1.458 -0.59 0 C-N-CA 121.757 1.638 . . . . 0.0 108.906 176.123 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 198' ' ' TYR . . . . . 0.551 ' H ' ' C ' ' B' ' 196' ' ' THR . 46.5 t80 . . . . . 0 C--O 1.249 1.066 0 CA-C-N 113.947 -1.479 . . . . 0.0 111.338 -178.811 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . 0.525 HG23 ' HA ' ' A' ' 62' ' ' THR . 27.4 mm . . . . . 0 N--CA 1.486 1.352 0 CA-C-O 120.761 0.315 . . . . 0.0 111.026 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.775 HG21 HG22 ' A' ' 15' ' ' THR . 8.2 p -176.9 150.02 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.876 -179.908 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.483 ' C ' ' CG ' ' A' ' 4' ' ' HIS . 3.8 p -111.99 -28.12 8.15 Favored 'General case' 0 C--O 1.224 -0.252 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 -179.193 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . 0.664 ' C ' HG12 ' A' ' 14' ' ' VAL . 0.0 OUTLIER 57.67 162.27 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.892 0.377 . . . . 0.0 110.682 -179.495 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.703 ' N ' HG12 ' A' ' 14' ' ' VAL . 1.4 m -96.4 35.93 1.42 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.485 -179.641 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.616 HG23 ' O ' ' A' ' 9' ' ' SER . 24.0 m -37.75 -34.5 0.11 Allowed 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.135 -179.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.915 ' HB3' HG13 ' A' ' 11' ' ' ILE . . . 34.79 80.66 0.02 OUTLIER 'General case' 0 N--CA 1.461 0.084 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.316 179.745 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.523 HG23 ' C ' ' A' ' 7' ' ' ALA . 1.9 p 80.15 -44.48 0.27 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.749 -0.659 . . . . 0.0 111.236 -179.546 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.616 ' O ' HG23 ' A' ' 6' ' ' THR . 0.0 OUTLIER -171.98 -68.4 0.0 OUTLIER Pre-proline 0 CA--C 1.535 0.374 0 N-CA-C 112.572 0.582 . . . . 0.0 112.572 179.741 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.471 ' HD3' ' CB ' ' A' ' 9' ' ' SER . 30.3 Cg_endo -84.11 -132.39 0.01 OUTLIER 'Trans proline' 0 CA--C 1.54 0.796 0 C-N-CA 122.333 2.022 . . . . 0.0 113.335 -178.744 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.915 HG13 ' HB3' ' A' ' 7' ' ' ALA . 24.5 mm 82.12 -110.38 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.511 0 C-N-CA 122.941 0.496 . . . . 0.0 111.699 -179.687 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.529 ' N ' HG22 ' A' ' 11' ' ' ILE . 1.2 m -161.96 -162.68 0.87 Allowed 'General case' 0 CA--C 1.53 0.183 0 O-C-N 121.978 -0.451 . . . . 0.0 111.609 -179.425 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -119.04 108.59 14.91 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.696 -179.52 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.703 HG12 ' N ' ' A' ' 5' ' ' THR . 0.2 OUTLIER -74.49 -56.51 8.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.165 179.568 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.775 HG22 HG21 ' A' ' 2' ' ' VAL . 5.5 p 66.58 128.42 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.389 -178.848 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.471 ' C ' ' CD ' ' A' ' 18' ' ' PRO . 1.7 m -130.13 68.65 81.29 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.098 -179.87 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.56 ' N ' ' CD ' ' A' ' 18' ' ' PRO . 61.6 Cg_endo -102.17 24.03 0.14 Allowed 'Trans proline' 0 CA--C 1.541 0.839 0 C-N-CA 123.417 2.745 . . . . 0.0 115.284 -178.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.56 ' CD ' ' N ' ' A' ' 17' ' ' PRO . 89.2 Cg_endo -82.96 -168.39 0.58 Allowed 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 121.659 1.572 . . . . 0.0 112.111 179.807 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -65.03 79.4 0.07 OUTLIER Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.55 -0.834 . . . . 0.0 111.967 179.669 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 66.42 118.08 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.903 0.382 . . . . 0.0 110.436 -179.47 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.467 ' O ' ' HB2' ' A' ' 22' ' ' LEU . 1.7 t-20 -146.05 -63.21 0.32 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.668 -179.735 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.773 HD13 ' HB3' ' A' ' 61' ' ' SER . 2.4 mm? 70.7 108.72 0.06 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.276 179.586 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.587 ' HA ' ' HA ' ' A' ' 44' ' ' CYS . 5.5 m -64.08 65.34 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 115.901 -0.591 . . . . 0.0 111.639 -179.784 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.57 ' CG ' ' HB2' ' A' ' 45' ' ' ALA . 0.1 OUTLIER -22.72 138.1 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 123.54 0.736 . . . . 0.0 112.639 179.985 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.585 ' CB ' HD23 ' A' ' 42' ' ' LEU . 0.2 OUTLIER -128.29 110.38 12.33 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.536 -179.683 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.865 ' HB3' HG12 ' A' ' 57' ' ' VAL . 1.5 ptpt -114.14 114.28 25.84 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.298 179.265 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -137.49 97.59 3.5 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.975 0.417 . . . . 0.0 111.272 -179.656 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' TRP . . . . . 0.859 ' CB ' HG21 ' A' ' 39' ' ' VAL . 0.0 OUTLIER -70.21 -165.8 0.11 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.741 179.453 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . 0.449 ' HB3' ' HA ' ' A' ' 33' ' ' CYS . 0.0 OUTLIER -132.22 -167.53 1.9 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.863 -179.249 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -90.31 -49.64 6.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.174 -179.816 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -155.5 -75.31 0.1 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.382 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.406 ' O ' ' CD2' ' A' ' 32' ' ' PHE . 33.7 t80 -90.44 14.08 13.94 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.42 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.449 ' HA ' ' HB3' ' A' ' 29' ' ' CYS . 93.9 m 48.84 79.67 0.07 Allowed 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.771 0.32 . . . . 0.0 111.088 -179.899 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 5.6 p -135.16 42.7 2.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.041 -179.831 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 60.84 35.22 19.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.014 179.831 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -129.76 31.08 4.79 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.871 179.889 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -104.81 -168.7 24.34 Favored Glycine 0 C--N 1.331 0.266 0 C-N-CA 120.83 -0.7 . . . . 0.0 112.643 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.87 27.85 0.18 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.737 0.303 . . . . 0.0 111.048 -179.89 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.859 HG21 ' CB ' ' A' ' 28' ' ' TRP . 23.6 t -78.01 132.24 32.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.664 179.675 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.731 HG21 ' HA ' ' B' ' 191' ' ' THR . 2.5 t -137.0 145.68 29.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.66 -178.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.604 ' H ' HD12 ' A' ' 42' ' ' LEU . 0.4 OUTLIER -176.86 -98.98 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.035 179.53 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.714 HD13 ' HA ' ' A' ' 67' ' ' PRO . 3.0 mp 57.46 157.6 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 120.623 0.249 . . . . 0.0 111.137 179.928 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 145.99 53.78 0.02 OUTLIER Glycine 0 C--N 1.335 0.518 0 C-N-CA 120.0 -1.095 . . . . 0.0 114.407 179.246 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.587 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 0.0 OUTLIER 57.32 157.87 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 117.373 0.587 . . . . 0.0 112.327 178.612 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.585 ' O ' ' HB3' ' A' ' 46' ' ' ALA . . . -151.11 -39.27 0.12 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.465 -0.788 . . . . 0.0 111.466 -179.718 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.585 ' HB3' ' O ' ' A' ' 45' ' ' ALA . . . 80.85 40.52 0.06 Allowed 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.975 -179.766 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.431 ' O ' HG23 ' A' ' 47' ' ' THR . 4.6 t -165.77 77.48 0.26 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.67 179.786 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.542 ' N ' ' HD2' ' A' ' 49' ' ' PRO . 52.9 t -69.07 -48.88 26.74 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.417 -179.737 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.542 ' HD2' ' N ' ' A' ' 48' ' ' CYS . 52.0 Cg_endo -69.89 58.95 1.66 Allowed 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 121.705 1.603 . . . . 0.0 110.04 178.628 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.426 ' N ' ' O ' ' A' ' 48' ' ' CYS . 42.8 t -110.0 -109.01 0.34 Allowed 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 114.977 -1.01 . . . . 0.0 111.057 -178.159 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.41 ' HG3' ' O ' ' A' ' 50' ' ' SER . 0.4 OUTLIER 36.17 77.54 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.323 0 N-CA-C 112.149 0.425 . . . . 0.0 112.149 179.808 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.55 ' HB2' ' HD3' ' A' ' 53' ' ' PRO . 0.0 OUTLIER -104.26 -56.4 0.09 OUTLIER Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.611 179.366 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . 0.55 ' HD3' ' HB2' ' A' ' 52' ' ' LYS . 11.8 Cg_endo -93.29 171.23 2.07 Favored 'Trans proline' 0 N--CA 1.453 -0.908 0 C-N-CA 123.167 2.578 . . . . 0.0 111.749 179.69 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -73.04 71.16 1.09 Allowed 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 120.842 0.353 . . . . 0.0 110.722 179.8 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -105.76 -150.57 0.44 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.289 -179.741 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.1 pm0 -140.18 15.84 2.43 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.216 -179.617 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.865 HG12 ' HB3' ' A' ' 26' ' ' LYS . 30.1 m -93.34 137.64 22.09 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-O 120.919 0.39 . . . . 0.0 111.385 -179.843 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 89.0 m -156.41 127.31 6.85 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.013 -179.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . 0.42 ' HB2' ' HG ' ' A' ' 22' ' ' LEU . 0.6 OUTLIER -43.44 133.75 4.2 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.89 179.773 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.571 ' HB2' ' O ' ' A' ' 23' ' ' CYS . 0.5 OUTLIER -114.97 -94.58 0.47 Allowed 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.905 -178.846 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.773 ' HB3' HD13 ' A' ' 22' ' ' LEU . 2.3 t 64.07 -76.48 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.79 0.329 . . . . 0.0 111.567 -179.848 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.525 ' HA ' HG23 ' A' ' 1' ' ' ILE . 9.3 t -44.22 134.05 5.07 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.135 -0.484 . . . . 0.0 112.044 -179.054 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 56.17 173.15 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.718 -0.673 . . . . 0.0 111.586 179.384 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.75 84.75 0.11 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.039 179.605 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -93.37 16.96 12.15 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.074 -0.512 . . . . 0.0 112.311 -178.705 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.481 ' ND2' ' O ' ' A' ' 3' ' ' CYS . 0.7 OUTLIER -54.04 163.16 1.25 Allowed Pre-proline 0 N--CA 1.465 0.275 0 CA-C-O 120.908 0.385 . . . . 0.0 111.15 179.841 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . 0.714 ' HA ' HD13 ' A' ' 42' ' ' LEU . 59.6 Cg_exo -51.25 124.89 15.04 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.709 2.273 . . . . 0.0 112.307 179.78 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 11.8 m-70 -133.75 99.78 13.83 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.856 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -48.81 165.66 0.17 Allowed 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.571 2.181 . . . . 0.0 112.46 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.8 ptmt -114.83 -30.1 6.54 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.976 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.44 ' O ' ' N ' ' A' ' 73' ' ' PRO . 7.4 pt20 -60.39 -16.49 36.1 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.37 179.866 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.67 ' CB ' ' CD ' ' A' ' 73' ' ' PRO . 20.1 mtm180 28.96 -87.09 0.0 OUTLIER Pre-proline 0 CA--C 1.54 0.56 0 C-N-CA 123.183 0.593 . . . . 0.0 112.463 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.67 ' CD ' ' CB ' ' A' ' 72' ' ' ARG . 28.7 Cg_endo -62.2 -178.17 0.33 Allowed 'Trans proline' 0 C--N 1.354 0.846 0 C-N-CA 121.634 1.556 . . . . 0.0 111.915 179.582 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.353 -1.248 . . . . 0.0 112.399 -179.97 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 181' ' ' TYR . . . . . . . . . . . . . 1.7 p90 . . . . . 0 N--CA 1.488 1.466 0 N-CA-C 111.676 0.25 . . . . 0.0 111.676 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 182' ' ' ARG . . . . . . . . . . . . . 8.8 mmm-85 -108.3 63.49 0.61 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.895 0.379 . . . . 0.0 110.811 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 183' ' ' GLY . . . . . . . . . . . . . . . -59.33 113.21 4.94 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.388 -179.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 184' ' ' TRP . . . . . . . . . . . . . 39.8 p90 -59.22 133.57 56.21 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.85 0.357 . . . . 0.0 110.942 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 185' ' ' LYS . . . . . . . . . . . . . 45.8 tttp -58.61 131.0 49.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.905 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 186' ' ' HIS . . . . . . . . . . . . . 96.2 m-70 -84.08 99.7 10.63 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.905 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 187' ' ' TRP . . . . . 0.472 ' HB2' ' CE1' ' B' ' 189' ' ' TYR . 0.6 OUTLIER -49.96 158.24 0.53 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.365 -179.955 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 2.0 p -94.37 -21.24 5.89 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.467 -179.588 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 189' ' ' TYR . . . . . 0.829 ' CB ' HG22 ' A' ' 39' ' ' VAL . 35.1 p90 -79.47 73.18 6.13 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.828 0.347 . . . . 0.0 111.397 -179.345 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 190' ' ' TYR . . . . . 0.413 ' O ' ' C ' ' B' ' 191' ' ' THR . 0.0 OUTLIER -160.6 123.06 3.23 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.194 179.923 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 191' ' ' THR . . . . . 0.731 ' HA ' HG21 ' A' ' 40' ' ' VAL . 0.1 OUTLIER -31.23 144.94 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.597 179.523 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 192' ' ' CYS . . . . . 0.705 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.1 OUTLIER -55.71 -60.8 2.94 Favored 'General case' 0 CA--C 1.5 -0.944 0 CA-C-O 121.506 0.67 . . . . 0.0 112.149 -179.253 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 193' ' ' CYS . . . . . 0.705 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.0 OUTLIER -162.45 163.37 18.36 Favored Pre-proline 0 N--CA 1.436 -1.161 0 CA-C-N 114.278 -1.328 . . . . 0.0 111.752 -173.46 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 194' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -82.74 130.99 6.07 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.768 2.312 . . . . 0.0 112.051 179.604 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 195' ' ' ASP . . . . . 0.451 ' HB3' ' OG ' ' A' ' 9' ' ' SER . 8.1 p-10 -63.84 80.81 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.02 -179.908 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 196' ' ' THR . . . . . 0.687 ' N ' ' CD ' ' B' ' 197' ' ' PRO . 0.7 OUTLIER -118.34 5.43 0.08 OUTLIER Pre-proline 0 C--N 1.328 -0.328 0 N-CA-C 113.763 1.023 . . . . 0.0 113.763 -179.636 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 197' ' ' PRO . . . . . 0.687 ' CD ' ' N ' ' B' ' 196' ' ' THR . 73.9 Cg_endo -74.04 21.93 0.37 Allowed 'Trans proline' 0 C--N 1.354 0.827 0 CA-C-N 120.53 1.225 . . . . 0.0 109.042 176.471 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 198' ' ' TYR . . . . . 0.646 ' H ' ' C ' ' B' ' 196' ' ' THR . 0.2 OUTLIER . . . . . 0 C--O 1.25 1.081 0 CA-C-N 114.058 -1.428 . . . . 0.0 111.379 -178.753 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . 0.579 ' N ' HD13 ' A' ' 1' ' ' ILE . 0.1 OUTLIER . . . . . 0 N--CA 1.485 1.313 0 CA-C-O 120.94 0.4 . . . . 0.0 111.132 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.701 HG12 ' HB ' ' A' ' 15' ' ' THR . 3.7 m -98.98 -171.02 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.735 179.751 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.568 ' C ' HG23 ' A' ' 14' ' ' VAL . 0.1 OUTLIER -148.14 88.33 1.65 Allowed 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 111.773 0.286 . . . . 0.0 111.773 -179.667 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . 0.922 ' N ' HG23 ' A' ' 14' ' ' VAL . 4.9 p-80 -59.0 126.79 29.17 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.888 0.375 . . . . 0.0 110.23 179.299 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.817 HG21 ' HB2' ' A' ' 12' ' ' SER . 75.0 p -47.21 -74.7 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.483 -179.395 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.41 ' N ' ' HB3' ' A' ' 10' ' ' PRO . 63.8 p 50.45 23.82 1.39 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.928 179.656 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -120.38 -161.12 0.86 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.564 -0.289 . . . . 0.0 110.327 179.436 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 1.3 t -49.01 96.81 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.146 0 CA-C-O 120.869 0.366 . . . . 0.0 110.066 179.45 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 1.6 m 69.63 77.66 0.23 Allowed Pre-proline 0 C--N 1.331 -0.235 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 -178.532 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.622 ' O ' HG22 ' A' ' 11' ' ' ILE . 29.7 Cg_endo -85.37 -135.38 0.02 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.403 0 C-N-CA 122.95 2.433 . . . . 0.0 112.034 -179.035 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.622 HG22 ' O ' ' A' ' 10' ' ' PRO . 1.1 tt 67.71 4.95 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.182 0 N-CA-C 112.579 0.585 . . . . 0.0 112.579 179.529 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.817 ' HB2' HG21 ' A' ' 5' ' ' THR . 0.2 OUTLIER -76.06 -166.85 0.65 Allowed 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 120.967 0.413 . . . . 0.0 111.649 -178.888 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -83.14 92.43 7.43 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.851 -0.613 . . . . 0.0 112.019 -179.217 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.922 HG23 ' N ' ' A' ' 4' ' ' HIS . 2.2 p -57.79 99.95 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.454 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.295 178.854 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.701 ' HB ' HG12 ' A' ' 2' ' ' VAL . 0.0 OUTLIER 169.67 116.83 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.831 0.348 . . . . 0.0 111.353 -179.446 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 30.1 t -114.17 137.77 22.63 Favored Pre-proline 0 C--N 1.332 -0.195 0 CA-C-N 116.278 -0.419 . . . . 0.0 109.963 178.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_exo -38.76 103.67 0.04 OUTLIER 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 122.901 2.401 . . . . 0.0 113.018 -179.769 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_exo -57.17 -160.25 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.724 2.283 . . . . 0.0 112.475 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 64.17 -86.67 0.07 OUTLIER Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.675 -0.774 . . . . 0.0 112.137 -179.809 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -105.07 142.32 35.06 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 110.252 -0.277 . . . . 0.0 110.252 179.53 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.408 ' HB3' ' N ' ' A' ' 45' ' ' ALA . 1.5 m-20 64.14 88.86 0.1 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.437 -179.617 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.466 ' HG ' ' CB ' ' A' ' 61' ' ' SER . 0.6 OUTLIER -73.66 -80.32 0.07 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.478 -179.49 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 8.4 m -158.52 29.04 0.23 Allowed 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 120.602 0.239 . . . . 0.0 111.546 -178.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.769 ' CD1' ' HB3' ' A' ' 45' ' ' ALA . 0.0 OUTLIER -83.49 161.93 21.09 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.075 0.464 . . . . 0.0 111.728 -178.973 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.533 ' CB ' ' HA ' ' A' ' 42' ' ' LEU . 0.9 OUTLIER -168.73 -79.08 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 115.718 -0.673 . . . . 0.0 110.973 178.889 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 177.7 165.97 0.66 Allowed 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.646 0.26 . . . . 0.0 110.767 179.844 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . 0.407 ' O ' ' HG3' ' A' ' 56' ' ' GLU . 0.0 OUTLIER -152.09 -167.18 2.69 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.143 -179.918 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' TRP . . . . . 0.848 ' CB ' HG21 ' A' ' 39' ' ' VAL . 2.5 t-105 -148.38 179.02 8.1 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.447 179.756 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -173.59 99.32 0.11 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.837 0.351 . . . . 0.0 111.117 -179.901 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 50.2 t0 -66.05 137.51 57.13 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.555 179.728 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . 59.22 -156.29 0.34 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.524 -179.751 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 14.1 m-85 -82.59 53.11 2.25 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.823 0.344 . . . . 0.0 110.904 179.785 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 56.9 m 44.95 30.06 0.53 Allowed 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.308 -179.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 92.3 p -82.24 -31.67 30.09 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.62 179.824 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -130.15 114.67 16.01 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.621 179.78 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 33.1 mmm-85 -57.12 133.89 55.39 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.229 -179.732 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.417 ' O ' ' N ' ' A' ' 39' ' ' VAL . . . -113.65 44.71 1.44 Allowed Glycine 0 C--N 1.33 0.248 0 C-N-CA 120.824 -0.703 . . . . 0.0 112.586 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.819 ' O ' HG13 ' A' ' 40' ' ' VAL . 0.2 OUTLIER 58.36 -80.74 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 122.218 0.207 . . . . 0.0 111.402 179.767 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.869 ' O ' HG22 ' A' ' 40' ' ' VAL . 3.1 p 35.92 -145.71 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 CA-C-O 119.342 -0.361 . . . . 0.0 111.557 -179.829 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.869 HG22 ' O ' ' A' ' 39' ' ' VAL . 1.5 m 91.23 151.46 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 C-N-CA 123.482 0.713 . . . . 0.0 111.455 -179.641 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 167.15 137.6 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.111 -179.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.696 ' N ' HD13 ' A' ' 42' ' ' LEU . 0.0 OUTLIER -142.28 153.4 43.88 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.03 0.443 . . . . 0.0 111.301 -179.775 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.427 ' N ' ' HB2' ' A' ' 25' ' ' ARG . . . -159.78 12.23 0.18 Allowed Glycine 0 N--CA 1.45 -0.388 0 CA-C-N 115.833 -0.622 . . . . 0.0 112.736 179.782 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.434 ' O ' ' HB2' ' A' ' 45' ' ' ALA . 3.3 m 62.65 147.62 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.897 0.38 . . . . 0.0 111.333 179.249 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.769 ' HB3' ' CD1' ' A' ' 24' ' ' TYR . . . 175.97 137.3 0.05 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.769 179.345 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -70.27 67.96 0.33 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.051 0.453 . . . . 0.0 110.795 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.816 HG22 ' HD3' ' A' ' 49' ' ' PRO . 89.0 m -164.77 147.09 8.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.817 -179.62 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -131.6 67.3 79.79 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.899 179.928 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.816 ' HD3' HG22 ' A' ' 47' ' ' THR . 32.6 Cg_exo -60.94 -11.22 17.22 Favored 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 122.466 2.111 . . . . 0.0 111.659 178.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 32.4 t -39.33 -68.7 0.15 Allowed 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 115.598 -0.728 . . . . 0.0 112.336 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 16.6 ptmt -90.69 77.16 6.37 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 120.923 0.392 . . . . 0.0 111.718 -179.238 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.624 ' HB3' ' CD ' ' A' ' 53' ' ' PRO . 0.6 OUTLIER -148.34 -167.11 0.15 Allowed Pre-proline 0 CA--C 1.538 0.494 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 179.682 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . 0.624 ' CD ' ' HB3' ' A' ' 52' ' ' LYS . 76.0 Cg_exo -51.96 -142.33 0.0 OUTLIER 'Trans proline' 0 C--N 1.356 0.947 0 C-N-CA 122.445 2.097 . . . . 0.0 113.198 -179.461 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -75.71 106.97 7.56 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 120.83 0.347 . . . . 0.0 111.782 -179.059 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -144.19 -157.91 0.83 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.585 179.104 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.407 ' HG3' ' O ' ' A' ' 27' ' ' MET . 0.3 OUTLIER -161.25 26.82 0.13 Allowed 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.432 -179.985 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.624 HG11 ' CE2' ' A' ' 24' ' ' TYR . 1.9 t -107.54 170.78 2.41 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.5 179.438 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.569 ' H ' HG12 ' A' ' 57' ' ' VAL . 10.7 p -148.22 40.54 0.95 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.14 179.718 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . 0.565 ' O ' ' CB ' ' A' ' 60' ' ' CYS . 80.4 m 56.06 -116.51 1.02 Allowed 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.802 -179.316 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.565 ' CB ' ' O ' ' A' ' 59' ' ' CYS . 2.4 m 139.17 47.07 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.476 0.71 . . . . 0.0 109.889 179.401 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.466 ' CB ' ' HG ' ' A' ' 22' ' ' LEU . 79.3 p -115.73 160.55 19.94 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.334 -179.424 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 1.3 m 73.84 17.68 3.51 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.934 -0.576 . . . . 0.0 111.635 179.732 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.9 p30 171.18 167.93 0.08 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 120.687 0.28 . . . . 0.0 110.909 179.71 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.494 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 0.0 OUTLIER -56.96 -32.79 66.39 Favored 'General case' 0 CA--C 1.516 -0.352 0 CA-C-O 121.498 0.666 . . . . 0.0 110.913 179.827 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . 0.408 ' HB3' ' O ' ' A' ' 64' ' ' LYS . 43.6 t 72.32 -44.36 0.59 Allowed 'General case' 0 C--N 1.313 -0.986 0 CA-C-N 114.727 -1.124 . . . . 0.0 112.689 179.03 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.455 ' HB2' ' NE2' ' A' ' 4' ' ' HIS . 0.3 OUTLIER -40.07 97.35 0.13 Allowed Pre-proline 0 N--CA 1.47 0.543 0 CA-C-O 120.697 0.284 . . . . 0.0 111.532 -178.92 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . 0.459 ' O ' ' CG ' ' A' ' 68' ' ' HIS . 6.7 Cg_exo -73.88 -2.24 11.96 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.953 2.435 . . . . 0.0 112.711 -179.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.459 ' CG ' ' O ' ' A' ' 67' ' ' PRO . 3.4 p80 55.98 168.49 0.05 OUTLIER Pre-proline 0 CA--C 1.53 0.202 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.085 -179.824 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 77.2 Cg_exo -50.53 114.42 1.45 Allowed 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.531 2.154 . . . . 0.0 112.325 -179.869 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.447 ' O ' ' N ' ' A' ' 72' ' ' ARG . 2.3 mtmm -61.52 -61.68 2.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.948 -179.925 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.4 ' HA ' ' CD ' ' A' ' 38' ' ' LYS . 1.3 tt0 52.37 -85.72 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.349 179.745 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.447 ' N ' ' O ' ' A' ' 70' ' ' LYS . 2.1 mmp_? -57.54 154.31 25.17 Favored Pre-proline 0 C--N 1.331 -0.212 0 CA-C-O 120.645 0.259 . . . . 0.0 110.781 179.825 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -59.1 -24.1 72.09 Favored 'Trans proline' 0 C--N 1.343 0.289 0 C-N-CA 122.594 2.196 . . . . 0.0 112.132 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.386 -1.23 . . . . 0.0 112.463 179.896 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 181' ' ' TYR . . . . . . . . . . . . . 47.0 m-85 . . . . . 0 N--CA 1.486 1.341 0 CA-C-O 120.844 0.354 . . . . 0.0 111.197 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 182' ' ' ARG . . . . . . . . . . . . . 8.3 ttt85 62.62 148.0 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.929 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 183' ' ' GLY . . . . . 0.463 ' O ' ' CG ' ' B' ' 184' ' ' TRP . . . -79.43 -18.22 74.22 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.636 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 184' ' ' TRP . . . . . 0.463 ' CG ' ' O ' ' B' ' 183' ' ' GLY . 6.6 p90 46.1 -172.97 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 120.848 0.356 . . . . 0.0 111.529 -179.879 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 185' ' ' LYS . . . . . . . . . . . . . 23.9 ttpp -92.73 128.91 38.76 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.051 -179.484 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 186' ' ' HIS . . . . . . . . . . . . . 7.5 p80 -87.79 -172.49 3.88 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.722 179.745 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 187' ' ' TRP . . . . . . . . . . . . . 9.5 m95 -90.16 155.04 19.31 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.009 0.433 . . . . 0.0 111.27 -179.75 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 188' ' ' VAL . . . . . 0.707 HG21 ' CZ ' ' B' ' 190' ' ' TYR . 0.2 OUTLIER -86.97 -152.57 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.161 179.488 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 189' ' ' TYR . . . . . . . . . . . . . 35.9 m-85 -97.55 31.71 2.49 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 120.93 0.395 . . . . 0.0 110.232 179.549 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 190' ' ' TYR . . . . . 0.707 ' CZ ' HG21 ' B' ' 188' ' ' VAL . 3.7 m-30 -79.48 112.19 16.48 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.919 -179.641 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 191' ' ' THR . . . . . . . . . . . . . 86.4 m -74.98 113.73 12.63 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.465 179.55 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 192' ' ' CYS . . . . . 0.687 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.0 OUTLIER -85.91 170.66 12.13 Favored 'General case' 0 CA--C 1.496 -1.113 0 CA-C-O 121.955 0.883 . . . . 0.0 111.352 -179.8 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 193' ' ' CYS . . . . . 0.687 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.1 OUTLIER 40.02 89.53 0.08 OUTLIER Pre-proline 0 N--CA 1.439 -0.983 0 CA-C-N 113.23 -1.805 . . . . 0.0 112.257 173.774 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 194' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_exo -49.07 176.93 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.61 2.206 . . . . 0.0 112.375 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 195' ' ' ASP . . . . . 0.427 ' HA ' ' HG3' ' A' ' 10' ' ' PRO . 11.1 p-10 -65.55 76.27 0.07 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.121 -179.882 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 196' ' ' THR . . . . . 0.697 ' N ' ' HD3' ' B' ' 197' ' ' PRO . 9.7 t -150.14 45.56 0.36 Allowed Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.934 179.862 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 197' ' ' PRO . . . . . 0.697 ' HD3' ' N ' ' B' ' 196' ' ' THR . 3.7 Cg_exo -76.27 13.55 1.3 Allowed 'Trans proline' 0 C--N 1.351 0.68 0 C-N-CA 121.797 1.665 . . . . 0.0 108.572 175.894 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 198' ' ' TYR . . . . . 0.556 ' H ' ' C ' ' B' ' 196' ' ' THR . 43.6 t80 . . . . . 0 C--O 1.249 1.075 0 CA-C-N 113.766 -1.561 . . . . 0.0 111.237 -178.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 2.8 pp . . . . . 0 N--CA 1.486 1.369 0 CA-C-O 120.789 0.328 . . . . 0.0 111.143 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.648 ' CG1' HG22 ' A' ' 15' ' ' THR . 22.5 t -144.91 148.46 17.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.55 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -97.31 -156.79 0.55 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.776 179.81 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . 0.508 ' CD2' ' HA ' ' A' ' 64' ' ' LYS . 2.2 p80 -123.89 151.25 43.71 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 178.745 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.917 HG22 ' HA ' ' A' ' 13' ' ' ALA . 42.9 p -60.14 114.17 2.73 Favored 'General case' 0 N--CA 1.439 -0.979 0 CA-C-O 121.554 0.692 . . . . 0.0 111.974 -178.43 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.598 ' O ' HG22 ' A' ' 6' ' ' THR . 64.5 m -151.39 27.95 0.65 Allowed 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 114.706 -1.134 . . . . 0.0 108.835 178.944 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.725 ' HB3' ' CB ' ' A' ' 12' ' ' SER . . . -39.31 -31.7 0.09 Allowed 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 115.346 -0.843 . . . . 0.0 112.357 -179.146 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 88.1 m -125.23 -72.69 0.66 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.78 0.324 . . . . 0.0 111.209 -179.796 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.528 ' CB ' ' CD ' ' A' ' 10' ' ' PRO . 0.4 OUTLIER -146.89 -69.81 0.02 OUTLIER Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.77 179.875 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.656 ' HB2' HD13 ' A' ' 11' ' ' ILE . 30.5 Cg_endo -63.89 -85.92 0.01 OUTLIER 'Trans proline' 0 C--N 1.348 0.525 0 C-N-CA 121.904 1.736 . . . . 0.0 111.759 179.614 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.656 HD13 ' HB2' ' A' ' 10' ' ' PRO . 0.0 OUTLIER -147.82 149.61 15.22 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.149 0 CA-C-O 120.679 0.275 . . . . 0.0 110.728 179.404 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.757 ' H ' ' HB ' ' A' ' 5' ' ' THR . 0.4 OUTLIER -159.65 -88.15 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 179.936 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.917 ' HA ' HG22 ' A' ' 5' ' ' THR . . . -179.97 124.37 0.07 Allowed 'General case' 0 CA--C 1.529 0.148 0 CA-C-O 120.755 0.312 . . . . 0.0 111.624 -179.84 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.462 HG21 ' O ' ' A' ' 4' ' ' HIS . 0.2 OUTLIER -120.3 -99.62 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.089 179.706 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.648 HG22 ' CG1' ' A' ' 2' ' ' VAL . 26.9 p 53.65 173.54 0.02 OUTLIER 'General case' 0 C--O 1.231 0.127 0 CA-C-O 121.076 0.465 . . . . 0.0 111.765 179.697 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.0 t -169.94 135.83 1.28 Allowed Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.151 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_endo -46.25 139.55 12.1 Favored 'Trans proline' 0 C--N 1.348 0.5 0 C-N-CA 122.706 2.271 . . . . 0.0 112.471 -179.717 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_exo -48.78 162.25 0.4 Allowed 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.612 2.208 . . . . 0.0 112.28 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 62.69 124.15 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.621 -0.799 . . . . 0.0 112.175 -179.782 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER 61.33 59.57 1.9 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.107 0.48 . . . . 0.0 110.655 -179.809 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 16.5 p-10 -155.29 96.05 1.77 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.53 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.409 ' O ' ' N ' ' A' ' 61' ' ' SER . 59.2 mt -112.79 28.16 9.02 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.615 -179.493 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.561 ' O ' ' HB3' ' A' ' 60' ' ' CYS . 7.8 t 37.08 67.44 0.35 Allowed 'General case' 0 C--O 1.222 -0.373 0 CA-C-N 116.6 -0.273 . . . . 0.0 111.608 179.331 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.85 ' CD2' ' HB2' ' A' ' 45' ' ' ALA . 0.0 OUTLIER -84.25 170.49 13.66 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 121.204 0.526 . . . . 0.0 112.366 -179.002 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.498 ' HB2' ' O ' ' A' ' 42' ' ' LEU . 0.0 OUTLIER 174.57 150.75 0.09 Allowed 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.477 -179.67 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.584 ' O ' ' CB ' ' A' ' 27' ' ' MET . 0.1 OUTLIER -144.83 -83.48 0.14 Allowed 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 120.765 -0.374 . . . . 0.0 111.821 179.996 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . 0.584 ' CB ' ' O ' ' A' ' 26' ' ' LYS . 5.7 ptt? 134.09 -144.84 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.989 0.916 . . . . 0.0 108.692 -179.155 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' TRP . . . . . 0.762 ' HB3' HG21 ' A' ' 39' ' ' VAL . 0.0 OUTLIER -169.9 170.46 7.71 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-O 120.71 0.29 . . . . 0.0 110.892 179.179 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 18.4 t -177.38 -77.05 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.919 179.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 170.41 -80.76 0.0 OUTLIER 'General case' 0 CA--C 1.529 0.17 0 CA-C-O 120.676 0.274 . . . . 0.0 110.992 179.875 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -161.97 -80.98 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.189 179.937 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 35.2 p90 -97.5 21.05 10.73 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.777 0.322 . . . . 0.0 111.087 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 2.3 p -75.51 125.28 28.71 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.0 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 5.5 m -62.92 -20.81 65.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.232 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 25.7 p -87.38 50.88 2.09 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.884 0.373 . . . . 0.0 111.013 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 4.6 ptt85 -67.04 81.87 0.12 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.97 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.439 ' HA3' ' HG2' ' A' ' 70' ' ' LYS . . . 163.31 -142.18 7.68 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.678 -0.773 . . . . 0.0 112.6 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.435 ' HD2' ' CD ' ' A' ' 70' ' ' LYS . 0.0 OUTLIER 65.93 -63.59 0.22 Allowed 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.523 0.202 . . . . 0.0 111.061 -179.745 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.884 HG13 ' HB3' ' B' ' 189' ' ' TYR . 2.3 t -54.72 106.97 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 121.079 0.466 . . . . 0.0 110.049 179.521 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.507 HG13 ' CG ' ' A' ' 69' ' ' PRO . 0.1 OUTLIER -39.62 155.82 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 N-CA-C 113.265 0.839 . . . . 0.0 113.265 -178.152 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.422 ' HG2' ' HG2' ' A' ' 25' ' ' ARG . 2.0 mp0 -100.32 -164.08 1.08 Allowed 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 114.51 -1.223 . . . . 0.0 111.206 -179.163 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.829 HD13 ' OH ' ' A' ' 24' ' ' TYR . 2.8 mt -120.52 -163.96 1.06 Allowed 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.659 -179.815 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.454 ' HA2' ' O ' ' A' ' 24' ' ' TYR . . . -160.43 123.97 1.28 Allowed Glycine 0 C--N 1.335 0.482 0 C-N-CA 120.329 -0.939 . . . . 0.0 113.73 -179.104 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.478 ' O ' ' CE1' ' A' ' 24' ' ' TYR . 0.5 OUTLIER 59.59 129.06 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 112.392 0.516 . . . . 0.0 112.392 179.075 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.85 ' HB2' ' CD2' ' A' ' 24' ' ' TYR . . . -140.73 -164.27 1.7 Allowed 'General case' 0 N--CA 1.461 0.103 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.176 179.921 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -132.04 20.32 4.51 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.602 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.466 HG23 ' HG2' ' A' ' 49' ' ' PRO . 1.5 m -178.58 124.07 0.1 Allowed 'General case' 0 CA--C 1.53 0.194 0 CA-C-O 120.777 0.322 . . . . 0.0 110.89 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.639 ' O ' ' N ' ' A' ' 50' ' ' SER . 47.5 t -77.83 -55.92 1.16 Allowed Pre-proline 0 C--N 1.332 -0.186 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.813 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.524 ' HD2' ' N ' ' A' ' 48' ' ' CYS . 4.0 Cg_exo -40.22 81.76 0.01 OUTLIER 'Trans proline' 0 C--N 1.356 0.967 0 C-N-CA 122.627 2.218 . . . . 0.0 111.411 179.842 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.639 ' N ' ' O ' ' A' ' 48' ' ' CYS . 41.1 t -131.25 8.31 4.68 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.296 -0.865 . . . . 0.0 111.541 -178.083 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 8.9 mtmt -61.93 -19.2 62.46 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.236 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.575 ' HB3' ' HD2' ' A' ' 53' ' ' PRO . 0.0 OUTLIER -57.15 179.64 0.13 Allowed Pre-proline 0 C--N 1.331 -0.227 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.311 179.894 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . 0.575 ' HD2' ' HB3' ' A' ' 52' ' ' LYS . 97.8 Cg_exo -45.14 -45.72 14.3 Favored 'Trans proline' 0 C--N 1.349 0.587 0 C-N-CA 122.353 2.036 . . . . 0.0 112.484 -179.833 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . 0.476 ' CE2' ' HB2' ' A' ' 52' ' ' LYS . 0.0 OUTLIER -69.61 65.47 0.2 Allowed 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 121.065 0.459 . . . . 0.0 110.63 179.705 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -82.16 -145.33 0.06 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.641 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.814 ' O ' HG13 ' A' ' 57' ' ' VAL . 15.9 tt0 76.22 20.95 1.52 Allowed 'General case' 0 CA--C 1.524 -0.046 0 CA-C-O 120.546 0.213 . . . . 0.0 110.813 -179.593 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.814 HG13 ' O ' ' A' ' 56' ' ' GLU . 0.0 OUTLIER 178.72 141.83 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.462 0.167 0 CA-C-O 121.064 0.459 . . . . 0.0 111.503 179.409 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 11.5 t -157.93 140.51 14.63 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.313 179.753 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 31.8 p -45.94 123.57 4.63 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 120.989 0.423 . . . . 0.0 111.381 -179.497 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.561 ' HB3' ' O ' ' A' ' 23' ' ' CYS . 0.1 OUTLIER -131.25 44.55 2.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.423 -179.707 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.409 ' N ' ' O ' ' A' ' 22' ' ' LEU . 8.8 p -80.81 132.2 35.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.355 -179.41 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.588 HG22 ' N ' ' A' ' 63' ' ' ASP . 1.2 m 177.21 -74.4 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.159 179.811 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . 0.588 ' N ' HG22 ' A' ' 62' ' ' THR . 67.9 t0 179.99 -37.76 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.595 179.846 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.508 ' HA ' ' CD2' ' A' ' 4' ' ' HIS . 1.5 mtpt -131.1 79.09 1.87 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.607 179.83 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . 0.461 ' HB3' ' HB3' ' A' ' 60' ' ' CYS . 0.0 OUTLIER -137.98 7.0 2.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.875 -179.718 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.506 ' HB2' ' HD2' ' A' ' 67' ' ' PRO . 0.1 OUTLIER -57.61 166.63 1.68 Allowed Pre-proline 0 N--CA 1.462 0.162 0 CA-C-O 120.493 0.187 . . . . 0.0 110.695 -179.991 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . 0.506 ' HD2' ' HB2' ' A' ' 66' ' ' ASN . 88.6 Cg_exo -44.72 162.96 0.07 OUTLIER 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.409 2.073 . . . . 0.0 112.161 179.688 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -176.24 64.05 0.22 Allowed Pre-proline 0 C--N 1.326 -0.427 0 CA-C-O 120.894 0.378 . . . . 0.0 111.068 -179.605 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.507 ' CG ' HG13 ' A' ' 40' ' ' VAL . 77.8 Cg_exo -49.57 129.59 23.75 Favored 'Trans proline' 0 C--N 1.344 0.31 0 C-N-CA 122.594 2.196 . . . . 0.0 111.751 179.556 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.503 ' O ' ' C ' ' A' ' 71' ' ' GLN . 0.4 OUTLIER -69.94 -47.25 63.12 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 120.836 -0.346 . . . . 0.0 111.564 -179.231 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.503 ' C ' ' O ' ' A' ' 70' ' ' LYS . 2.2 tt0 19.79 53.53 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 179.743 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.43 ' N ' ' O ' ' A' ' 70' ' ' LYS . 0.1 OUTLIER -79.8 132.63 60.43 Favored Pre-proline 0 C--N 1.33 -0.241 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.014 -179.509 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -77.9 -167.77 0.52 Allowed 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 122.554 2.169 . . . . 0.0 112.418 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.097 0 CA-C-O 118.398 -1.223 . . . . 0.0 112.582 180.0 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 181' ' ' TYR . . . . . . . . . . . . . 10.4 t80 . . . . . 0 N--CA 1.486 1.374 0 CA-C-O 120.859 0.362 . . . . 0.0 111.279 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 182' ' ' ARG . . . . . . . . . . . . . 11.5 tpt180 -57.86 136.56 57.02 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.984 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 183' ' ' GLY . . . . . . . . . . . . . . . -53.21 103.08 0.12 Allowed Glycine 0 CA--C 1.518 0.266 0 C-N-CA 120.847 -0.692 . . . . 0.0 112.708 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 184' ' ' TRP . . . . . . . . . . . . . 21.3 p90 -100.69 151.43 21.66 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.732 0.301 . . . . 0.0 110.893 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 185' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -177.42 141.24 0.3 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.952 179.926 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 186' ' ' HIS . . . . . . . . . . . . . 9.2 p80 -79.94 63.49 4.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.812 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 187' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -57.22 -68.17 0.25 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.013 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 2.3 p -82.67 125.28 39.93 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.314 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.925 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 189' ' ' TYR . . . . . 0.884 ' HB3' HG13 ' A' ' 39' ' ' VAL . 0.1 OUTLIER -84.26 133.51 34.56 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.418 179.894 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 190' ' ' TYR . . . . . . . . . . . . . 44.9 t80 -160.04 135.94 8.53 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.294 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 191' ' ' THR . . . . . 0.452 ' HB ' ' HG2' ' A' ' 69' ' ' PRO . 14.5 t -33.12 141.32 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 115.876 -0.602 . . . . 0.0 112.145 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 192' ' ' CYS . . . . . 0.685 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.1 OUTLIER -90.33 169.5 11.05 Favored 'General case' 0 CA--C 1.499 -0.993 0 CA-C-O 122.252 1.025 . . . . 0.0 111.972 -179.759 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 193' ' ' CYS . . . . . 0.685 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.1 OUTLIER 36.27 92.71 0.05 OUTLIER Pre-proline 0 C--N 1.314 -0.955 0 CA-C-N 112.795 -2.002 . . . . 0.0 113.119 173.394 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 194' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -59.27 145.03 99.1 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.592 2.195 . . . . 0.0 112.042 179.549 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 78.6 m-20 -131.35 12.17 5.0 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.515 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 196' ' ' THR . . . . . 0.59 ' N ' ' CD ' ' B' ' 197' ' ' PRO . 0.2 OUTLIER -122.26 35.4 0.26 Allowed Pre-proline 0 C--N 1.33 -0.27 0 N-CA-C 112.096 0.406 . . . . 0.0 112.096 179.873 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 197' ' ' PRO . . . . . 0.59 ' CD ' ' N ' ' B' ' 196' ' ' THR . 77.9 Cg_endo -74.73 15.7 0.68 Allowed 'Trans proline' 0 C--N 1.35 0.638 0 C-N-CA 121.551 1.501 . . . . 0.0 108.967 176.203 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 198' ' ' TYR . . . . . 0.589 ' H ' ' C ' ' B' ' 196' ' ' THR . 7.9 t80 . . . . . 0 C--O 1.249 1.028 0 CA-C-N 114.033 -1.44 . . . . 0.0 111.25 -178.741 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . 0.574 HG23 ' O ' ' A' ' 62' ' ' THR . 5.1 mp . . . . . 0 N--CA 1.485 1.322 0 CA-C-O 120.421 0.153 . . . . 0.0 111.13 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.659 ' HB ' HG22 ' A' ' 15' ' ' THR . 33.3 m 45.82 -179.34 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.312 0 CA-C-O 120.897 0.379 . . . . 0.0 111.865 -179.788 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 55.9 m -128.78 -139.76 0.24 Allowed 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.999 -179.165 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . 0.952 ' O ' HG22 ' A' ' 14' ' ' VAL . 0.3 OUTLIER -109.48 -95.77 0.4 Allowed 'General case' 0 CA--C 1.53 0.188 0 O-C-N 122.406 -0.184 . . . . 0.0 110.53 179.926 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.767 ' HA ' HG13 ' A' ' 14' ' ' VAL . 2.3 t -145.13 145.66 31.48 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.974 0.416 . . . . 0.0 110.916 179.396 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.839 HG21 ' HA2' ' A' ' 43' ' ' GLY . 9.6 p -103.19 77.92 1.58 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.892 -179.81 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.498 ' O ' HG23 ' A' ' 8' ' ' THR . . . -177.96 -68.67 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.174 -179.875 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.498 HG23 ' O ' ' A' ' 7' ' ' ALA . 0.6 OUTLIER -162.91 147.16 11.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.797 -179.817 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.602 ' H ' HG23 ' B' ' 191' ' ' THR . 0.4 OUTLIER 57.97 174.55 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.959 179.98 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -80.17 -88.37 0.0 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.51 0 C-N-CA 122.487 2.125 . . . . 0.0 111.842 179.671 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.461 ' O ' ' CB ' ' A' ' 12' ' ' SER . 1.2 mp 70.34 -57.72 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.16 0 N-CA-C 112.203 0.446 . . . . 0.0 112.203 179.134 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.467 ' HA ' ' HA ' ' A' ' 4' ' ' HIS . 1.2 m 84.58 111.44 0.05 Allowed 'General case' 0 N--CA 1.464 0.225 0 CA-C-O 120.835 0.35 . . . . 0.0 110.511 -179.104 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -163.81 -31.8 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.695 -179.597 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.952 HG22 ' O ' ' A' ' 4' ' ' HIS . 2.0 m -41.11 -86.59 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.354 0 N-CA-C 111.478 0.177 . . . . 0.0 111.478 -179.727 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.826 ' H ' HG23 ' A' ' 14' ' ' VAL . 26.2 p 51.07 104.63 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.904 0.383 . . . . 0.0 111.9 179.423 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.658 ' N ' ' HD3' ' A' ' 17' ' ' PRO . 28.3 p -138.87 49.67 2.36 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.021 178.668 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.658 ' HD3' ' N ' ' A' ' 16' ' ' CYS . 35.6 Cg_exo -60.29 -44.87 25.62 Favored 'Trans proline' 0 C--N 1.353 0.783 0 C-N-CA 122.675 2.25 . . . . 0.0 113.42 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.488 ' HD2' ' N ' ' A' ' 17' ' ' PRO . 37.3 Cg_exo -38.2 -44.08 1.88 Allowed 'Trans proline' 0 C--N 1.349 0.593 0 C-N-CA 122.918 2.412 . . . . 0.0 113.401 -179.259 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -107.93 -136.22 7.89 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.476 -0.868 . . . . 0.0 113.143 -179.692 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.562 ' CB ' ' HA ' ' A' ' 46' ' ' ALA . 0.3 OUTLIER -35.71 -42.94 0.27 Allowed 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 112.937 0.717 . . . . 0.0 112.937 -179.347 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.416 ' N ' ' HG2' ' A' ' 20' ' ' GLU . 0.1 OUTLIER 79.19 -52.52 0.44 Allowed 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 114.845 -1.07 . . . . 0.0 110.926 -179.398 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.783 ' O ' ' HA ' ' A' ' 44' ' ' CYS . 0.4 OUTLIER -59.72 118.25 5.93 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 179.368 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.565 ' HA ' ' HA ' ' A' ' 44' ' ' CYS . 6.0 m -80.44 39.7 0.47 Allowed 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 113.091 0.775 . . . . 0.0 113.091 -178.514 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.541 ' CG ' ' HB2' ' A' ' 45' ' ' ALA . 0.1 OUTLIER 43.67 -165.58 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.375 0 CA-C-O 120.71 0.29 . . . . 0.0 111.204 179.55 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.543 ' CB ' HG23 ' A' ' 58' ' ' THR . 0.1 OUTLIER -179.97 90.2 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.979 -0.288 . . . . 0.0 111.615 179.717 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.732 ' HG2' HG13 ' A' ' 57' ' ' VAL . 4.8 mtmt -84.09 110.82 18.78 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.796 179.538 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 1.6 ttp -131.03 92.2 3.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.312 -179.803 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' TRP . . . . . 0.631 ' HB2' HG11 ' A' ' 39' ' ' VAL . 0.0 OUTLIER -67.12 -159.81 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.409 179.574 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 93.5 m -148.94 157.54 43.5 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.852 0.358 . . . . 0.0 110.986 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -137.71 121.02 16.97 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.676 179.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.427 ' C ' ' CG ' ' A' ' 32' ' ' PHE . . . 62.22 90.39 0.07 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.814 -179.717 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.427 ' CG ' ' C ' ' A' ' 31' ' ' ALA . 4.6 p90 44.48 30.11 0.46 Allowed 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.361 -179.79 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 9.2 t 43.55 55.75 4.78 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.37 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -156.74 28.38 0.32 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.657 179.803 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.429 ' O ' ' C ' ' A' ' 36' ' ' ARG . 43.2 m -138.24 37.86 2.3 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.585 -179.891 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.446 ' HG3' ' HB2' ' A' ' 70' ' ' LYS . 0.2 OUTLIER 25.84 89.77 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 115.739 -0.664 . . . . 0.0 112.275 179.55 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.44 ' N ' ' HG3' ' A' ' 70' ' ' LYS . . . -80.06 -127.33 0.66 Allowed Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.639 -0.791 . . . . 0.0 113.315 -179.557 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.429 ' O ' ' HB3' ' B' ' 190' ' ' TYR . 0.0 OUTLIER -173.46 99.89 0.12 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.947 0.404 . . . . 0.0 110.211 -179.302 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.631 HG11 ' HB2' ' A' ' 28' ' ' TRP . 58.7 t -155.89 139.94 8.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.578 179.942 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.622 HG23 HD21 ' A' ' 42' ' ' LEU . 7.1 p -161.56 159.89 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.869 -179.47 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.52 ' C ' ' HG ' ' A' ' 42' ' ' LEU . 13.9 tp10 -173.32 -58.36 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.379 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.622 HD21 HG23 ' A' ' 40' ' ' VAL . 0.0 OUTLIER 44.12 -168.82 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.861 -179.348 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.839 ' HA2' HG21 ' A' ' 6' ' ' THR . . . 141.58 37.64 0.09 OUTLIER Glycine 0 C--N 1.328 0.102 0 C-N-CA 120.157 -1.021 . . . . 0.0 113.678 179.447 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.783 ' HA ' ' O ' ' A' ' 22' ' ' LEU . 59.2 m 61.99 141.26 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.887 0.344 . . . . 0.0 111.348 179.191 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.541 ' HB2' ' CG ' ' A' ' 24' ' ' TYR . . . -130.0 -99.57 0.33 Allowed 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 112.042 0.386 . . . . 0.0 112.042 -179.557 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.562 ' HA ' ' CB ' ' A' ' 20' ' ' GLU . . . -179.33 -41.4 0.01 OUTLIER 'General case' 0 C--O 1.23 0.057 0 CA-C-O 120.906 0.384 . . . . 0.0 110.958 -179.368 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 4.7 t -178.12 45.65 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.118 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.462 ' N ' ' HD3' ' A' ' 49' ' ' PRO . 10.1 m 55.68 62.9 6.78 Favored Pre-proline 0 C--N 1.332 -0.195 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.374 179.733 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.462 ' HD3' ' N ' ' A' ' 48' ' ' CYS . 5.4 Cg_exo -76.47 3.9 5.96 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.755 2.303 . . . . 0.0 111.502 178.862 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.478 ' O ' ' HB2' ' A' ' 51' ' ' LYS . 30.3 t -51.05 -62.55 1.55 Allowed 'General case' 0 N--CA 1.455 -0.195 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.519 -179.804 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.478 ' HB2' ' O ' ' A' ' 50' ' ' SER . 9.5 mtpt 77.87 -50.28 0.5 Allowed 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.483 -179.729 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.36 133.16 20.72 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.003 -179.739 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . 0.401 ' HG2' ' CE1' ' A' ' 54' ' ' TYR . 69.2 Cg_endo -76.16 -47.94 0.15 Allowed 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.534 2.156 . . . . 0.0 112.612 -179.855 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . 0.404 ' O ' ' CZ3' ' A' ' 28' ' ' TRP . 0.0 OUTLIER -51.94 -25.94 9.32 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.101 -179.911 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -55.56 -85.36 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.94 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 167.33 -74.92 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 120.945 0.402 . . . . 0.0 110.971 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.732 HG13 ' HG2' ' A' ' 26' ' ' LYS . 2.8 m -50.54 154.37 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 115.899 -0.592 . . . . 0.0 111.924 -179.615 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.543 HG23 ' CB ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -164.1 -95.25 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.992 179.648 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -151.11 160.15 44.06 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 120.94 0.4 . . . . 0.0 111.315 -179.699 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.501 ' HB2' ' O ' ' A' ' 24' ' ' TYR . 0.1 OUTLIER -138.7 -18.59 1.07 Allowed 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.609 179.846 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.657 ' O ' HG23 ' A' ' 62' ' ' THR . 83.1 p -42.8 106.33 0.06 Allowed 'General case' 0 N--CA 1.462 0.17 0 CA-C-O 120.843 0.354 . . . . 0.0 111.859 -179.503 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.657 HG23 ' O ' ' A' ' 61' ' ' SER . 4.0 p -164.84 -76.45 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.601 179.646 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 30.6 p-10 177.58 -39.31 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.704 179.821 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.414 ' O ' ' ND2' ' A' ' 66' ' ' ASN . 0.0 OUTLIER -160.81 56.52 0.31 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.998 -0.547 . . . . 0.0 110.486 179.712 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . 0.426 ' O ' ' C ' ' A' ' 66' ' ' ASN . 1.3 p -55.12 -62.73 1.47 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.366 -179.499 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.431 ' ND2' ' CE1' ' A' ' 4' ' ' HIS . 9.2 p30 29.69 62.02 0.86 Allowed Pre-proline 0 N--CA 1.468 0.466 0 C-N-CA 122.625 0.37 . . . . 0.0 111.962 -179.78 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . 0.417 ' HG2' ' HG2' ' A' ' 25' ' ' ARG . 54.0 Cg_exo -52.35 -57.21 2.24 Favored 'Trans proline' 0 C--N 1.343 0.274 0 C-N-CA 122.651 2.234 . . . . 0.0 112.8 -179.631 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.468 ' HB3' ' HD2' ' A' ' 69' ' ' PRO . 15.7 m170 62.34 161.01 0.12 Allowed Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.349 -179.671 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.468 ' HD2' ' HB3' ' A' ' 68' ' ' HIS . 67.7 Cg_exo -36.23 126.07 0.37 Allowed 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 123.046 2.497 . . . . 0.0 112.791 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.446 ' HB2' ' HG3' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -57.44 -16.9 10.68 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.288 -179.977 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.51 64.54 0.18 Allowed 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.969 0.414 . . . . 0.0 110.736 179.652 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.713 ' N ' ' HD2' ' A' ' 73' ' ' PRO . 5.3 ptp180 -60.11 -42.5 90.22 Favored Pre-proline 0 CA--C 1.534 0.353 0 N-CA-C 112.423 0.527 . . . . 0.0 112.423 -179.705 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.713 ' HD2' ' N ' ' A' ' 72' ' ' ARG . 5.0 Cg_endo -47.14 -26.89 5.73 Favored 'Trans proline' 0 C--N 1.352 0.721 0 C-N-CA 122.309 2.006 . . . . 0.0 112.513 -179.695 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.387 -1.229 . . . . 0.0 112.445 179.858 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 181' ' ' TYR . . . . . . . . . . . . . 17.8 m-85 . . . . . 0 N--CA 1.486 1.351 0 CA-C-O 120.814 0.34 . . . . 0.0 111.134 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 182' ' ' ARG . . . . . . . . . . . . . 13.6 ttt-85 60.86 156.39 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.912 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 183' ' ' GLY . . . . . . . . . . . . . . . 64.99 72.42 0.72 Allowed Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.406 -179.844 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 184' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -78.69 -2.8 40.95 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.561 0.219 . . . . 0.0 111.409 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 185' ' ' LYS . . . . . . . . . . . . . 3.5 tttp 63.7 137.41 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.115 0 CA-C-O 120.859 0.361 . . . . 0.0 110.957 179.875 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 186' ' ' HIS . . . . . . . . . . . . . 8.4 t60 -90.11 164.54 14.43 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.754 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 187' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -78.61 -176.36 4.81 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.832 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 188' ' ' VAL . . . . . 0.472 HG12 ' H ' ' B' ' 189' ' ' TYR . 0.2 OUTLIER -80.12 -172.7 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.675 179.712 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 189' ' ' TYR . . . . . 0.472 ' H ' HG12 ' B' ' 188' ' ' VAL . 3.2 m-85 -95.78 56.2 1.71 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.69 179.897 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 190' ' ' TYR . . . . . 0.464 ' CZ ' ' HA ' ' B' ' 192' ' ' CYS . 1.2 p90 -108.3 149.46 28.62 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.234 -179.678 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 191' ' ' THR . . . . . 0.602 HG23 ' H ' ' A' ' 9' ' ' SER . 24.2 m -62.19 86.63 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.022 0.439 . . . . 0.0 110.487 179.502 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 192' ' ' CYS . . . . . 0.7 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.5 OUTLIER -35.95 -54.37 0.76 Allowed 'General case' 0 CA--C 1.501 -0.939 0 CA-C-O 121.965 0.888 . . . . 0.0 112.296 -179.603 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 193' ' ' CYS . . . . . 0.7 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.0 OUTLIER -150.28 107.73 3.17 Favored Pre-proline 0 N--CA 1.434 -1.227 0 CA-C-N 113.492 -1.685 . . . . 0.0 111.903 -173.736 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 194' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -76.36 178.47 7.49 Favored 'Trans proline' 0 C--N 1.348 0.522 0 C-N-CA 122.545 2.163 . . . . 0.0 112.054 179.735 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 195' ' ' ASP . . . . . 0.414 ' C ' ' HD3' ' B' ' 197' ' ' PRO . 4.8 t0 55.06 100.18 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.916 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 196' ' ' THR . . . . . 0.754 ' N ' ' HD3' ' B' ' 197' ' ' PRO . 1.8 t -112.08 20.57 0.07 OUTLIER Pre-proline 0 CA--C 1.533 0.293 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 -179.783 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 197' ' ' PRO . . . . . 0.754 ' HD3' ' N ' ' B' ' 196' ' ' THR . 6.6 Cg_exo -68.52 19.43 0.14 Allowed 'Trans proline' 0 C--N 1.358 1.068 0 CA-C-N 120.382 1.172 . . . . 0.0 109.6 176.302 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 198' ' ' TYR . . . . . 0.679 ' H ' ' C ' ' B' ' 196' ' ' THR . 64.9 t80 . . . . . 0 C--O 1.249 1.046 0 CA-C-N 114.535 -1.211 . . . . 0.0 111.248 -178.828 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . 0.837 HG22 ' HB2' ' A' ' 63' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.445 0 CA-C-O 120.827 0.346 . . . . 0.0 110.989 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.736 ' CG1' HG13 ' A' ' 14' ' ' VAL . 48.9 t -125.7 133.27 69.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.796 179.629 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.982 ' O ' HG21 ' A' ' 14' ' ' VAL . 19.4 m -92.33 65.22 4.53 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -178.545 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . 0.517 ' C ' ' O ' ' A' ' 3' ' ' CYS . 0.5 OUTLIER -10.49 93.03 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 112.651 0.611 . . . . 0.0 112.651 179.596 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.753 HG21 ' HB3' ' A' ' 9' ' ' SER . 0.0 OUTLIER 39.24 -166.07 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 115.951 -0.568 . . . . 0.0 112.042 179.492 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.601 ' O ' ' HB3' ' A' ' 7' ' ' ALA . 3.9 t -99.25 23.31 9.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.712 179.836 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.601 ' HB3' ' O ' ' A' ' 6' ' ' THR . . . 86.87 -31.3 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.624 -179.847 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.695 ' OG1' HG22 ' B' ' 191' ' ' THR . 0.2 OUTLIER -67.08 -27.76 67.63 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.673 0.273 . . . . 0.0 111.149 -179.824 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.753 ' HB3' HG21 ' A' ' 5' ' ' THR . 5.7 t -123.36 152.02 63.68 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.916 -179.911 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_endo -64.41 -48.46 4.51 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.437 2.091 . . . . 0.0 112.33 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 12.9 tt -178.62 144.37 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.158 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 17.6 t -157.58 -81.23 0.06 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.201 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -152.76 57.02 0.8 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.961 0.41 . . . . 0.0 110.761 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.982 HG21 ' O ' ' A' ' 3' ' ' CYS . 2.8 p -74.81 -107.22 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.083 -179.451 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.722 ' H ' HG13 ' A' ' 14' ' ' VAL . 3.3 p 62.26 144.8 0.02 OUTLIER 'General case' 0 CA--C 1.522 -0.118 0 CA-C-O 120.944 0.402 . . . . 0.0 110.895 -179.956 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.508 ' HB3' ' CD ' ' A' ' 17' ' ' PRO . 0.1 OUTLIER -148.02 -65.41 0.02 OUTLIER Pre-proline 0 C--N 1.326 -0.449 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.607 -179.834 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.67 ' HB2' HD12 ' A' ' 1' ' ' ILE . 9.2 Cg_endo -52.09 100.1 0.05 OUTLIER 'Trans proline' 0 C--N 1.348 0.545 0 C-N-CA 122.62 2.213 . . . . 0.0 112.861 -179.633 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.404 ' CD ' ' HB2' ' A' ' 21' ' ' ASN . 1.9 Cg_endo -82.16 -57.83 0.03 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.55 0 C-N-CA 122.993 2.462 . . . . 0.0 111.451 179.494 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -124.98 -40.81 0.4 Allowed Glycine 0 N--CA 1.45 -0.421 0 CA-C-N 115.836 -0.62 . . . . 0.0 112.009 179.559 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 24.9 tp10 -160.11 68.33 0.38 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.897 0.38 . . . . 0.0 110.83 179.86 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.404 ' HB2' ' CD ' ' A' ' 18' ' ' PRO . 2.9 m-80 -140.95 83.51 1.89 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.045 -179.856 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.833 HD13 ' CB ' ' A' ' 61' ' ' SER . 47.2 mt -52.29 151.54 3.9 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.814 0.34 . . . . 0.0 111.11 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.584 ' HA ' ' HA ' ' A' ' 44' ' ' CYS . 5.3 t -78.66 167.91 20.53 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.6 179.845 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.64 ' CE1' ' HB2' ' A' ' 45' ' ' ALA . 0.2 OUTLIER -121.49 -176.31 3.27 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-O 120.737 0.303 . . . . 0.0 110.902 179.851 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 4.5 ttm180 -176.28 97.76 0.06 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.254 179.889 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.538 ' HG2' HG12 ' A' ' 57' ' ' VAL . 2.7 mtpt -80.65 148.23 30.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.298 179.487 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -154.17 98.61 2.16 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.835 0.35 . . . . 0.0 111.605 -179.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' TRP . . . . . 0.514 ' HB3' HG11 ' A' ' 39' ' ' VAL . 1.8 t90 -77.86 -144.68 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.32 179.409 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 38.5 t -176.71 -36.4 0.01 OUTLIER 'General case' 0 C--O 1.231 0.083 0 CA-C-O 120.744 0.307 . . . . 0.0 111.11 -179.814 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 1.6 t70 77.84 -61.46 0.4 Allowed 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.906 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -174.24 96.17 0.09 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.884 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER 58.88 104.62 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.405 -179.627 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -112.41 -83.56 0.59 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.277 -179.645 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 4.1 p 70.09 -60.22 0.49 Allowed 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.765 0.317 . . . . 0.0 110.639 -179.574 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -110.51 -21.77 11.99 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.964 179.794 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.59 -86.19 0.03 OUTLIER 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 116.627 -0.261 . . . . 0.0 110.945 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.562 ' O ' HG22 ' A' ' 39' ' ' VAL . . . 73.84 -88.48 0.65 Allowed Glycine 0 C--N 1.334 0.455 0 C-N-CA 120.467 -0.873 . . . . 0.0 112.741 179.896 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.462 ' HB3' ' HB2' ' A' ' 70' ' ' LYS . 0.0 OUTLIER 31.54 45.9 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 121.065 0.46 . . . . 0.0 111.872 -179.826 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.562 HG22 ' O ' ' A' ' 37' ' ' GLY . 5.3 m -140.04 90.68 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.829 179.956 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.608 HG21 ' OG1' ' B' ' 191' ' ' THR . 26.9 m -113.07 162.06 11.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.296 -179.704 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 178.38 35.44 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.199 179.858 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.554 HD23 ' H ' ' A' ' 42' ' ' LEU . 0.4 OUTLIER -61.99 128.88 38.27 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.504 179.794 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -135.67 7.49 4.23 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.427 -0.892 . . . . 0.0 113.376 -179.719 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.584 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 0.5 OUTLIER 61.44 131.83 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.169 0.509 . . . . 0.0 111.847 179.345 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.64 ' HB2' ' CE1' ' A' ' 24' ' ' TYR . . . -104.29 -171.83 2.0 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.895 179.861 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -120.54 -16.24 8.35 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 112.117 0.414 . . . . 0.0 112.117 -179.716 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 5.1 t -160.76 26.51 0.15 Allowed 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 111.902 0.334 . . . . 0.0 111.902 -179.784 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER 51.6 53.6 13.48 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-O 120.686 0.279 . . . . 0.0 111.06 179.583 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -70.41 58.88 1.91 Allowed 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.285 1.99 . . . . 0.0 110.338 178.606 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 36.3 t -130.12 133.3 46.55 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.474 -0.784 . . . . 0.0 111.024 -178.364 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 175.22 46.08 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.799 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.405 ' HB2' ' HD2' ' A' ' 53' ' ' PRO . 0.6 OUTLIER -127.96 164.17 38.73 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.707 -179.963 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . 0.414 ' O ' ' HG2' ' A' ' 55' ' ' GLU . 11.2 Cg_endo -54.91 -162.97 0.01 OUTLIER 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.725 2.283 . . . . 0.0 112.268 -180.0 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -46.59 96.27 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.378 -179.863 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.414 ' HG2' ' O ' ' A' ' 53' ' ' PRO . 0.2 OUTLIER -113.67 -82.57 0.6 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.908 179.718 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 177.12 -57.43 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.788 0.328 . . . . 0.0 110.97 179.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.538 HG12 ' HG2' ' A' ' 26' ' ' LYS . 27.4 m -65.32 154.96 7.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.353 -179.808 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 11.6 t -147.45 22.63 1.16 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.906 179.716 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 10.8 m 60.02 110.92 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.179 179.858 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.498 ' HB3' ' C ' ' A' ' 23' ' ' CYS . 46.9 t -100.29 35.27 2.13 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.422 179.599 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.833 ' CB ' HD13 ' A' ' 22' ' ' LEU . 52.9 p -60.79 80.25 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.117 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.73 -180.0 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.67 HG22 ' HG2' ' A' ' 64' ' ' LYS . 55.0 m 179.47 -33.24 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.364 -0.835 . . . . 0.0 109.384 -179.77 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . 0.837 ' HB2' HG22 ' A' ' 1' ' ' ILE . 0.8 OUTLIER 70.63 60.91 0.2 Allowed 'General case' 0 C--O 1.23 0.077 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.724 179.548 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.67 ' HG2' HG22 ' A' ' 62' ' ' THR . 5.5 ptmm? 178.82 39.71 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.647 179.267 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 2.3 m -103.01 17.71 23.41 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.04 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 6.6 p-10 -137.55 87.1 17.94 Favored Pre-proline 0 C--N 1.332 -0.186 0 CA-C-O 120.727 0.299 . . . . 0.0 111.481 -179.715 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -79.61 -42.32 0.17 Allowed 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.687 2.258 . . . . 0.0 112.041 179.71 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.419 ' HB3' ' HD2' ' A' ' 69' ' ' PRO . 53.6 m80 -133.28 162.03 60.17 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.534 179.863 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.446 ' HB3' ' C ' ' B' ' 191' ' ' THR . 75.7 Cg_exo -49.39 -63.75 0.27 Allowed 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.414 2.076 . . . . 0.0 112.615 -179.859 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.462 ' HB2' ' HB3' ' A' ' 38' ' ' LYS . 0.0 OUTLIER -88.57 -159.19 0.53 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.834 -179.809 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 39.9 tt0 -96.7 41.69 1.1 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.803 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.03 110.29 2.86 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.859 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -71.12 145.29 48.99 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.467 2.111 . . . . 0.0 112.3 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.131 0 CA-C-O 118.354 -1.248 . . . . 0.0 112.541 -179.988 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 181' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 . . . . . 0 N--CA 1.487 1.397 0 CA-C-O 120.927 0.394 . . . . 0.0 111.16 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 182' ' ' ARG . . . . . . . . . . . . . 1.7 tpp180 66.26 -75.99 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.832 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 183' ' ' GLY . . . . . . . . . . . . . . . 85.76 26.96 33.37 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.425 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 184' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -60.97 177.02 0.36 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.801 0.334 . . . . 0.0 110.85 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 185' ' ' LYS . . . . . 0.418 ' O ' ' CD2' ' B' ' 186' ' ' HIS . 0.0 OUTLIER -174.38 -59.48 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.135 179.959 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 186' ' ' HIS . . . . . 0.418 ' CD2' ' O ' ' B' ' 185' ' ' LYS . 14.1 m80 -142.91 92.37 2.39 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.737 0.304 . . . . 0.0 111.197 -179.839 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 187' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -59.45 -71.39 0.13 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.963 0.411 . . . . 0.0 110.445 179.582 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 188' ' ' VAL . . . . . 0.532 HG23 ' OH ' ' B' ' 190' ' ' TYR . 0.2 OUTLIER -79.68 -165.91 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.496 179.691 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 189' ' ' TYR . . . . . 0.469 ' H ' HG12 ' B' ' 188' ' ' VAL . 35.4 m-85 -104.74 98.78 8.47 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.769 0.319 . . . . 0.0 111.574 -179.431 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 190' ' ' TYR . . . . . 0.532 ' OH ' HG23 ' B' ' 188' ' ' VAL . 0.0 OUTLIER -123.39 105.26 9.67 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.515 179.265 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 191' ' ' THR . . . . . 0.695 HG22 ' OG1' ' A' ' 8' ' ' THR . 0.9 OUTLIER -90.27 17.48 7.09 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.519 -179.982 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 192' ' ' CYS . . . . . 0.719 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.0 OUTLIER -43.22 174.01 0.0 OUTLIER 'General case' 0 CA--C 1.5 -0.962 0 CA-C-O 122.015 0.912 . . . . 0.0 112.198 -179.713 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 193' ' ' CYS . . . . . 0.719 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.0 OUTLIER 47.18 82.45 0.23 Allowed Pre-proline 0 N--CA 1.438 -1.037 0 CA-C-N 113.466 -1.697 . . . . 0.0 111.945 173.799 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 194' ' ' PRO . . . . . 0.408 ' HA ' ' O ' ' A' ' 8' ' ' THR . 50.0 Cg_exo -53.81 172.55 0.25 Allowed 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.677 2.251 . . . . 0.0 112.482 -179.899 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 195' ' ' ASP . . . . . 0.427 ' HB2' ' CD ' ' B' ' 197' ' ' PRO . 8.5 m-20 -71.6 -161.83 0.07 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.815 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 196' ' ' THR . . . . . 0.766 ' C ' ' H ' ' B' ' 198' ' ' TYR . 41.5 p -89.83 -5.17 0.1 Allowed Pre-proline 0 CA--C 1.532 0.256 0 N-CA-C 113.793 1.034 . . . . 0.0 113.793 -179.337 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 197' ' ' PRO . . . . . 0.669 ' CD ' ' N ' ' B' ' 196' ' ' THR . 22.8 Cg_exo -62.29 20.98 0.05 OUTLIER 'Trans proline' 0 C--N 1.357 1.014 0 CA-C-N 120.944 1.373 . . . . 0.0 110.282 177.327 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 198' ' ' TYR . . . . . 0.766 ' H ' ' C ' ' B' ' 196' ' ' THR . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.056 0 CA-C-N 114.713 -1.13 . . . . 0.0 110.931 -179.342 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . 0.463 HG23 ' HA ' ' A' ' 62' ' ' THR . 1.7 mp . . . . . 0 N--CA 1.486 1.341 0 CA-C-O 120.953 0.406 . . . . 0.0 111.139 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.539 HG21 ' HB ' ' A' ' 15' ' ' THR . 0.3 OUTLIER -160.87 178.15 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.191 -179.914 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.467 ' N ' HG13 ' A' ' 2' ' ' VAL . 4.6 m -67.82 -159.7 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.252 179.79 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . 0.457 ' CE1' ' ND2' ' A' ' 66' ' ' ASN . 0.0 OUTLIER -156.84 142.05 17.28 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-O 121.263 0.554 . . . . 0.0 112.122 179.978 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.577 ' HB ' ' HA ' ' A' ' 11' ' ' ILE . 13.4 p -53.98 -31.03 49.48 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.428 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.56 -6.55 1.14 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.61 179.188 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.4 ' O ' ' HB ' ' A' ' 8' ' ' THR . . . -73.0 132.62 43.63 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.199 179.945 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.614 HG23 ' OG1' ' B' ' 191' ' ' THR . 89.4 m 64.03 -77.23 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.077 179.862 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.537 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.0 OUTLIER -101.3 172.65 4.26 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.629 -179.98 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.537 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 10.6 Cg_endo -51.69 -42.77 55.0 Favored 'Trans proline' 0 C--N 1.345 0.392 0 C-N-CA 122.383 2.055 . . . . 0.0 111.456 179.509 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.878 HD12 ' CE2' ' B' ' 198' ' ' TYR . 11.3 mt -149.45 126.03 2.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.636 179.526 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.517 ' H ' ' HB ' ' A' ' 5' ' ' THR . 0.9 OUTLIER -138.6 -17.56 1.12 Allowed 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 112.425 0.528 . . . . 0.0 112.425 -179.462 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.477 ' HA ' HG22 ' A' ' 5' ' ' THR . . . 56.76 58.0 4.38 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.976 0.417 . . . . 0.0 110.819 -179.603 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.78 HG22 ' O ' ' A' ' 14' ' ' VAL . 4.6 p -91.69 29.66 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.243 -179.447 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.539 ' HB ' HG21 ' A' ' 2' ' ' VAL . 30.6 p -73.98 120.94 20.25 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.794 0.331 . . . . 0.0 111.299 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.405 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 1.1 t -58.22 141.43 82.28 Favored Pre-proline 0 CA--C 1.532 0.257 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.472 179.592 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.48 ' HB2' ' HD3' ' A' ' 18' ' ' PRO . 38.6 Cg_exo -58.4 -49.93 10.95 Favored 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 122.298 1.999 . . . . 0.0 112.83 -179.542 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.48 ' HD3' ' HB2' ' A' ' 17' ' ' PRO . 89.3 Cg_endo -81.46 -171.82 1.32 Allowed 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.499 2.133 . . . . 0.0 112.412 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -112.73 144.5 17.97 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.175 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 58.14 72.25 0.53 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.921 0.391 . . . . 0.0 110.65 -179.814 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -119.86 -7.34 10.0 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.647 -179.353 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.978 HD12 ' CB ' ' A' ' 48' ' ' CYS . 1.5 mt 61.88 88.33 0.09 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.53 0.205 . . . . 0.0 110.838 179.773 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.446 ' HA ' ' CA ' ' A' ' 44' ' ' CYS . 1.7 t -59.5 73.94 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.494 -179.794 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.471 ' CB ' ' HA ' ' A' ' 59' ' ' CYS . 0.0 OUTLIER -114.97 156.59 24.78 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.843 -179.069 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.477 ' HB2' ' C ' ' A' ' 42' ' ' LEU . 2.8 ttt180 -144.7 -81.09 0.17 Allowed 'General case' 0 CA--C 1.53 0.208 0 CA-C-O 120.836 0.35 . . . . 0.0 111.559 179.146 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 2.8 mtmm -179.77 110.52 0.04 OUTLIER 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.318 -179.725 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . 0.543 ' N ' ' HB3' ' A' ' 41' ' ' GLU . 0.5 OUTLIER -89.19 122.54 32.58 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.843 -179.586 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' TRP . . . . . 0.413 ' HB2' ' CB ' ' A' ' 39' ' ' VAL . 0.0 OUTLIER -87.58 -179.86 6.4 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.856 0.36 . . . . 0.0 110.986 179.966 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 8.4 m -158.93 -178.04 6.95 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.798 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -109.24 -75.75 0.62 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.842 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -127.37 -70.07 0.72 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.975 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 37.6 t80 -102.27 -29.34 11.74 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.848 179.821 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 62.23 85.62 0.12 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.786 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 11.4 p -98.97 -57.57 2.14 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.976 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 2.3 p -135.11 31.69 3.22 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.991 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 2.8 mtt85 -107.84 -81.41 0.56 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.872 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 49.83 39.37 32.06 Favored Glycine 0 C--N 1.331 0.271 0 C-N-CA 120.818 -0.706 . . . . 0.0 112.775 179.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.572 ' HA ' ' HG2' ' A' ' 70' ' ' LYS . 0.0 OUTLIER -73.33 -179.66 3.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.712 0.291 . . . . 0.0 111.068 -179.814 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.856 HG13 ' O ' ' B' ' 189' ' ' TYR . 29.8 t 80.82 -3.55 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.868 -178.561 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.6 HG11 HG21 ' B' ' 191' ' ' THR . 17.9 m 43.09 -172.8 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.461 0.079 0 N-CA-C 112.674 0.62 . . . . 0.0 112.674 179.231 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.543 ' HB3' ' N ' ' A' ' 27' ' ' MET . 0.3 OUTLIER -169.46 89.91 0.2 Allowed 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.716 -179.07 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.789 HD22 ' ND2' ' A' ' 66' ' ' ASN . 1.6 pp -158.09 127.87 5.97 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-O 121.411 0.624 . . . . 0.0 112.307 179.409 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.432 ' N ' ' O ' ' A' ' 24' ' ' TYR . . . -156.85 -1.34 0.1 OUTLIER Glycine 0 N--CA 1.45 -0.387 0 CA-C-N 115.012 -0.995 . . . . 0.0 112.509 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.483 ' HA ' ' O ' ' A' ' 22' ' ' LEU . 0.7 OUTLIER 59.25 129.86 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.197 0 N-CA-C 113.362 0.875 . . . . 0.0 113.362 178.528 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.416 ' O ' ' N ' ' A' ' 47' ' ' THR . . . -152.92 113.27 4.02 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.091 -0.959 . . . . 0.0 110.237 178.76 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.503 ' C ' HG22 ' A' ' 47' ' ' THR . . . -60.75 78.61 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.97 -179.316 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.676 HG23 ' H ' ' A' ' 48' ' ' CYS . 0.0 OUTLIER 167.71 -77.61 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.688 179.331 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.978 ' CB ' HD12 ' A' ' 22' ' ' LEU . 0.0 OUTLIER 47.41 63.1 10.75 Favored Pre-proline 0 C--O 1.233 0.209 0 CA-C-O 120.991 0.424 . . . . 0.0 111.944 179.353 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.443 ' HD3' ' N ' ' A' ' 48' ' ' CYS . 74.2 Cg_endo -94.84 11.45 1.62 Allowed 'Trans proline' 0 N--CA 1.451 -1.029 0 C-N-CA 123.371 2.714 . . . . 0.0 110.99 178.62 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 46.2 t -61.89 142.11 57.59 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 115.289 -0.869 . . . . 0.0 111.731 -179.241 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 6.9 mttm -164.94 54.1 0.12 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.178 179.718 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.469 ' CB ' ' HD2' ' A' ' 53' ' ' PRO . 0.0 OUTLIER -112.73 168.37 7.79 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.931 -179.525 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . 0.469 ' HD2' ' CB ' ' A' ' 52' ' ' LYS . 12.5 Cg_endo -55.81 -162.05 0.01 OUTLIER 'Trans proline' 0 C--N 1.348 0.536 0 C-N-CA 122.778 2.318 . . . . 0.0 112.375 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -55.08 89.63 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.177 -179.871 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -102.73 -73.69 0.65 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.524 179.691 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 172.82 -36.15 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.864 179.868 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 5.5 m -92.05 137.24 22.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.132 0.492 . . . . 0.0 111.911 -179.381 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.411 ' O ' ' HB2' ' A' ' 59' ' ' CYS . 60.1 p -108.85 -19.53 13.37 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.498 179.235 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . 0.471 ' HA ' ' CB ' ' A' ' 24' ' ' TYR . 5.4 m 69.19 103.94 0.06 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.864 179.767 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.453 ' O ' ' HB3' ' A' ' 22' ' ' LEU . 0.0 OUTLIER -74.37 -160.39 0.1 Allowed 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.703 179.831 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.706 ' HB2' HD22 ' A' ' 22' ' ' LEU . 0.0 OUTLIER 167.72 137.69 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 120.958 0.409 . . . . 0.0 111.623 179.518 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.463 ' HA ' HG23 ' A' ' 1' ' ' ILE . 0.0 OUTLIER 35.09 -91.66 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 115.474 -0.784 . . . . 0.0 112.158 179.318 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . 0.41 ' O ' ' N ' ' A' ' 65' ' ' CYS . 9.3 p-10 -55.82 125.64 22.19 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.84 0.353 . . . . 0.0 111.257 -179.689 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 3.3 pttp -56.32 86.98 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.654 179.796 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . 0.41 ' N ' ' O ' ' A' ' 63' ' ' ASP . 0.1 OUTLIER -77.24 58.69 1.66 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.297 -179.641 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.789 ' ND2' HD22 ' A' ' 42' ' ' LEU . 1.0 OUTLIER -167.06 55.87 0.34 Allowed Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.756 179.24 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . 0.566 ' HD3' ' N ' ' A' ' 66' ' ' ASN . 26.2 Cg_exo -62.03 -65.67 0.06 OUTLIER 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 122.516 2.144 . . . . 0.0 112.41 -179.782 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -110.85 158.32 36.06 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.757 -179.838 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 7.9 Cg_exo -71.09 -74.63 0.01 OUTLIER 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.643 2.229 . . . . 0.0 112.314 -179.691 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.577 ' HD2' ' N ' ' A' ' 70' ' ' LYS . 0.0 OUTLIER 177.41 -102.16 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 116.686 -0.234 . . . . 0.0 111.396 -179.969 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 37.3 tp60 -67.1 89.63 0.18 Allowed 'General case' 0 C--O 1.231 0.086 0 CA-C-O 120.713 0.292 . . . . 0.0 111.216 -179.572 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -162.59 59.04 0.87 Allowed Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.869 179.756 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -63.49 -27.24 70.23 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.511 2.141 . . . . 0.0 112.185 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.143 0 CA-C-O 118.355 -1.247 . . . . 0.0 112.458 179.985 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 181' ' ' TYR . . . . . . . . . . . . . 1.1 p90 . . . . . 0 N--CA 1.486 1.345 0 CA-C-O 120.745 0.307 . . . . 0.0 111.196 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 182' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 71.57 32.99 1.92 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.719 -179.806 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 183' ' ' GLY . . . . . . . . . . . . . . . -107.65 -15.37 15.36 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.769 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 184' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -56.25 155.95 6.25 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.802 0.334 . . . . 0.0 111.052 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 185' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -146.57 -165.83 2.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.962 179.813 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 186' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -140.04 86.61 2.1 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.942 -179.74 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 187' ' ' TRP . . . . . . . . . . . . . 48.3 p90 -74.89 162.48 28.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.055 0.455 . . . . 0.0 111.055 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 188' ' ' VAL . . . . . 0.431 ' CG1' ' CE2' ' B' ' 190' ' ' TYR . 0.1 OUTLIER -97.94 161.09 2.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.914 -179.869 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 189' ' ' TYR . . . . . 0.856 ' O ' HG13 ' A' ' 39' ' ' VAL . 12.4 m-85 -112.18 -8.36 13.99 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.534 179.444 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 190' ' ' TYR . . . . . 0.467 ' CD1' ' N ' ' B' ' 190' ' ' TYR . 0.0 OUTLIER -79.48 143.32 35.03 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 120.853 0.358 . . . . 0.0 110.692 -179.653 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 191' ' ' THR . . . . . 0.614 ' OG1' HG23 ' A' ' 8' ' ' THR . 1.4 t -73.83 -25.35 60.04 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.97 -179.904 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 192' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -45.31 178.31 0.0 OUTLIER 'General case' 0 CA--C 1.504 -0.811 0 CA-C-O 122.03 0.919 . . . . 0.0 112.347 -179.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 193' ' ' CYS . . . . . 0.487 ' N ' ' HD3' ' B' ' 194' ' ' PRO . 0.6 OUTLIER 31.24 58.42 1.07 Allowed Pre-proline 0 N--CA 1.438 -1.049 0 CA-C-N 112.782 -2.008 . . . . 0.0 113.209 172.609 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 194' ' ' PRO . . . . . 0.487 ' HD3' ' N ' ' B' ' 193' ' ' CYS . 57.1 Cg_endo -90.53 -68.31 0.01 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.801 0 C-N-CA 122.779 2.319 . . . . 0.0 112.502 179.9 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 178.94 129.77 0.07 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.84 0.352 . . . . 0.0 110.801 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 196' ' ' THR . . . . . 0.676 ' N ' ' HD3' ' B' ' 197' ' ' PRO . 11.4 t -139.4 46.2 1.04 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.95 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 197' ' ' PRO . . . . . 0.676 ' HD3' ' N ' ' B' ' 196' ' ' THR . 5.7 Cg_exo -73.54 12.62 0.84 Allowed 'Trans proline' 0 C--N 1.35 0.639 0 C-N-CA 121.688 1.592 . . . . 0.0 108.699 175.963 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 198' ' ' TYR . . . . . 0.878 ' CE2' HD12 ' A' ' 11' ' ' ILE . 8.2 t80 . . . . . 0 C--O 1.249 1.076 0 CA-C-N 113.963 -1.471 . . . . 0.0 111.273 -178.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . 0.758 HG23 ' O ' ' A' ' 62' ' ' THR . 29.0 mm . . . . . 0 N--CA 1.486 1.369 0 CA-C-O 120.729 0.299 . . . . 0.0 111.07 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.968 HG21 HG22 ' A' ' 15' ' ' THR . 3.6 p -172.37 170.69 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.002 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.565 ' H ' HG22 ' A' ' 2' ' ' VAL . 1.4 p -113.3 -162.14 0.79 Allowed 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 116.649 -0.25 . . . . 0.0 111.112 -179.521 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . 0.921 ' HA ' HG22 ' A' ' 14' ' ' VAL . 1.6 p80 -146.3 -175.96 4.98 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.874 0.369 . . . . 0.0 111.089 -179.851 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.886 HG23 ' CB ' ' A' ' 12' ' ' SER . 0.1 OUTLIER -97.9 80.97 2.8 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.69 179.963 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.532 HG21 ' O ' ' A' ' 67' ' ' PRO . 96.7 m -89.77 -3.68 58.04 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.826 179.705 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.518 ' HA ' HG22 ' B' ' 191' ' ' THR . . . -79.4 131.66 36.16 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.738 0.304 . . . . 0.0 110.828 179.838 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 5.1 p 56.67 26.44 11.26 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.696 -179.647 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 81.1 p -169.4 151.15 4.39 Favored Pre-proline 0 C--N 1.33 -0.24 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.886 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.858 ' HG2' HG22 ' B' ' 196' ' ' THR . 34.9 Cg_endo -65.32 -54.01 0.7 Allowed 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.668 2.246 . . . . 0.0 112.633 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 20.0 tt -154.86 152.3 9.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.312 -179.738 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.886 ' CB ' HG23 ' A' ' 5' ' ' THR . 4.3 m -176.53 -158.36 0.05 Allowed 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.163 -179.915 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.4 ' H ' ' HB3' ' A' ' 12' ' ' SER . . . -136.27 135.17 38.77 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-O 120.822 0.344 . . . . 0.0 111.417 -179.868 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.921 HG22 ' HA ' ' A' ' 4' ' ' HIS . 21.1 m -117.24 -53.78 4.27 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.141 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.656 179.695 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.968 HG22 HG21 ' A' ' 2' ' ' VAL . 1.2 p 29.69 79.01 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 122.645 0.378 . . . . 0.0 111.875 -179.781 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.4 m -39.16 96.13 0.11 Allowed Pre-proline 0 CA--C 1.533 0.297 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.874 -179.5 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.579 ' N ' ' HD2' ' A' ' 18' ' ' PRO . 6.8 Cg_endo -53.26 -49.29 17.99 Favored 'Trans proline' 0 C--N 1.348 0.542 0 C-N-CA 122.679 2.253 . . . . 0.0 113.843 -179.393 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.579 ' HD2' ' N ' ' A' ' 17' ' ' PRO . 12.3 Cg_endo -55.83 -80.34 0.02 OUTLIER 'Trans proline' 0 C--N 1.349 0.582 0 C-N-CA 122.186 1.924 . . . . 0.0 112.733 -179.162 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -151.8 -148.31 4.8 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.49 -0.862 . . . . 0.0 112.65 -179.789 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 58.36 -179.39 0.07 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.798 0.332 . . . . 0.0 110.663 -179.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.609 ' H ' HD12 ' A' ' 22' ' ' LEU . 14.0 p30 -177.25 39.29 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.898 -179.988 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.738 HD22 ' SG ' ' A' ' 48' ' ' CYS . 0.4 OUTLIER -146.72 81.67 1.56 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.758 179.935 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.837 ' HA ' ' H ' ' A' ' 44' ' ' CYS . 6.5 m -58.02 120.66 8.95 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.994 -179.698 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.897 ' CD1' ' HB2' ' A' ' 45' ' ' ALA . 0.4 OUTLIER -133.47 -32.66 1.14 Allowed 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 113.032 0.753 . . . . 0.0 113.032 -178.303 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.627 ' HB2' ' C ' ' A' ' 42' ' ' LEU . 1.6 ttm180 37.1 -117.55 0.15 Allowed 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 112.677 0.621 . . . . 0.0 112.677 -178.504 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.45 ' C ' ' HB3' ' A' ' 41' ' ' GLU . 0.0 OUTLIER -156.41 126.49 6.48 Favored 'General case' 0 C--N 1.344 0.332 0 C-N-CA 122.351 0.26 . . . . 0.0 110.574 -179.513 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . 0.477 ' HB2' ' CG ' ' A' ' 41' ' ' GLU . 3.0 tmm? -104.92 159.33 15.89 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.606 0.241 . . . . 0.0 110.881 -179.688 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' TRP . . . . . 0.415 ' O ' ' HA2' ' A' ' 37' ' ' GLY . 3.2 t-105 -130.21 143.71 50.94 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.904 0.383 . . . . 0.0 111.286 179.84 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . 0.516 ' HB3' ' N ' ' A' ' 37' ' ' GLY . 0.0 OUTLIER 61.48 131.98 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.853 -179.9 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 3.7 t0 -178.76 -177.94 0.54 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.747 179.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . 64.28 -80.8 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.287 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -120.54 56.58 0.98 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.838 0.351 . . . . 0.0 111.033 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 46.4 t -127.04 83.63 2.19 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.909 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 37.2 p -48.59 -43.11 35.73 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-O 120.948 0.404 . . . . 0.0 110.697 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.445 ' O ' ' C ' ' A' ' 36' ' ' ARG . 0.3 OUTLIER -93.27 -151.01 0.29 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.921 179.335 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.475 ' HB3' ' CB ' ' A' ' 29' ' ' CYS . 0.3 OUTLIER 28.6 -139.97 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 122.593 0.357 . . . . 0.0 111.62 179.178 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.516 ' N ' ' HB3' ' A' ' 29' ' ' CYS . . . 65.35 9.23 41.83 Favored Glycine 0 C--N 1.338 0.66 0 C-N-CA 120.041 -1.076 . . . . 0.0 113.17 179.839 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.573 ' HB2' ' CB ' ' B' ' 190' ' ' TYR . 0.0 OUTLIER -99.61 -1.66 37.57 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 117.071 0.436 . . . . 0.0 110.991 179.736 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.709 HG22 ' CD1' ' B' ' 189' ' ' TYR . 4.7 t -78.73 86.62 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 CA-C-O 120.974 0.416 . . . . 0.0 110.147 178.907 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.4 ' CG2' ' CG2' ' B' ' 191' ' ' THR . 30.2 m -50.01 -179.93 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.813 -0.63 . . . . 0.0 112.38 -178.681 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.757 ' O ' ' HG3' ' A' ' 41' ' ' GLU . 5.1 pt-20 -157.71 97.82 1.6 Allowed 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 112.462 0.541 . . . . 0.0 112.462 -178.584 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.875 HD22 ' ND2' ' A' ' 66' ' ' ASN . 0.1 OUTLIER -159.09 112.69 2.33 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.748 0.785 . . . . 0.0 112.833 178.704 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.425 ' N ' ' HB2' ' A' ' 25' ' ' ARG . . . -162.44 26.66 0.24 Allowed Glycine 0 N--CA 1.449 -0.496 0 CA-C-N 114.352 -1.294 . . . . 0.0 111.387 179.413 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.837 ' H ' ' HA ' ' A' ' 23' ' ' CYS . 70.8 m 65.4 140.84 0.02 OUTLIER 'General case' 0 N--CA 1.461 0.115 0 CA-C-O 120.977 0.417 . . . . 0.0 111.685 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.897 ' HB2' ' CD1' ' A' ' 24' ' ' TYR . . . -117.19 -82.47 0.63 Allowed 'General case' 0 C--O 1.232 0.143 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.214 179.779 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.548 ' HB2' ' O ' ' A' ' 45' ' ' ALA . . . 169.22 -39.37 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.897 0.38 . . . . 0.0 110.963 -179.861 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.7 m -162.71 -7.77 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 116.078 -0.51 . . . . 0.0 112.018 -179.417 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.738 ' SG ' HD22 ' A' ' 22' ' ' LEU . 1.5 m 64.22 59.35 1.64 Allowed Pre-proline 0 C--N 1.332 -0.186 0 CA-C-O 120.539 0.209 . . . . 0.0 111.234 179.842 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.51 ' HD3' ' N ' ' A' ' 48' ' ' CYS . 2.9 Cg_endo -79.99 -2.02 11.8 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 122.675 2.25 . . . . 0.0 111.473 178.906 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 34.7 t -53.91 144.78 17.88 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.727 -0.669 . . . . 0.0 111.575 -179.857 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 7.5 pttt 179.99 75.22 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.767 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.42 ' HB2' ' HD2' ' A' ' 53' ' ' PRO . 0.6 OUTLIER -150.49 162.68 26.7 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.837 -179.864 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . 0.42 ' HD2' ' HB2' ' A' ' 52' ' ' LYS . 9.8 Cg_endo -50.81 -72.6 0.04 OUTLIER 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.741 2.294 . . . . 0.0 112.257 179.887 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -55.11 -27.11 42.73 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.953 179.904 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 59.21 -87.31 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.952 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.424 ' O ' HG13 ' A' ' 57' ' ' VAL . 13.3 tt0 72.91 6.53 5.36 Favored 'General case' 0 CA--C 1.528 0.115 0 CA-C-O 120.586 0.232 . . . . 0.0 111.207 -179.868 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.448 HG12 ' CD2' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -169.54 145.92 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-O 120.844 0.354 . . . . 0.0 110.839 179.97 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.523 HG22 ' CD ' ' A' ' 41' ' ' GLU . 0.0 OUTLIER -145.74 -99.58 0.1 Allowed 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.562 179.655 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . 0.481 ' HA ' ' HB3' ' A' ' 24' ' ' TYR . 0.8 OUTLIER 167.45 172.41 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 120.778 0.323 . . . . 0.0 110.648 179.772 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.536 ' HB2' ' O ' ' A' ' 23' ' ' CYS . 9.7 t -125.05 -86.49 0.63 Allowed 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.117 -179.603 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.453 ' O ' HG23 ' A' ' 62' ' ' THR . 19.6 p 53.59 -158.23 0.16 Allowed 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 120.603 0.24 . . . . 0.0 111.223 179.663 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.758 ' O ' HG23 ' A' ' 1' ' ' ILE . 0.1 OUTLIER 46.83 -90.46 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.565 -179.966 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -127.03 -178.74 4.53 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.817 0.342 . . . . 0.0 111.099 -179.795 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.9 ptpp? -68.22 73.53 0.21 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.854 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 18.0 p -57.28 -31.0 65.16 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.263 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.875 ' ND2' HD22 ' A' ' 42' ' ' LEU . 1.5 m-80 -31.16 92.82 0.05 OUTLIER Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 115.656 -0.702 . . . . 0.0 112.477 -178.642 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . 0.532 ' O ' HG21 ' A' ' 6' ' ' THR . 71.7 Cg_endo -90.04 -170.93 0.44 Allowed 'Trans proline' 0 N--CA 1.457 -0.63 0 C-N-CA 123.029 2.486 . . . . 0.0 112.56 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.474 ' HB3' ' HD2' ' A' ' 69' ' ' PRO . 27.3 m80 -110.52 166.01 11.59 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.366 179.707 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.474 ' HD2' ' HB3' ' A' ' 68' ' ' HIS . 83.0 Cg_exo -49.13 133.1 28.99 Favored 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 122.393 2.062 . . . . 0.0 112.013 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.421 ' O ' ' N ' ' A' ' 72' ' ' ARG . 0.1 OUTLIER -46.73 -41.13 14.66 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.473 -179.463 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -65.13 73.61 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.682 179.915 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.421 ' N ' ' O ' ' A' ' 70' ' ' LYS . 0.0 OUTLIER -61.89 147.71 89.19 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.045 -179.852 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -68.89 -25.73 32.51 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 122.586 2.191 . . . . 0.0 112.274 179.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.118 0 CA-C-O 118.346 -1.252 . . . . 0.0 112.386 179.98 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 181' ' ' TYR . . . . . . . . . . . . . 4.3 m-85 . . . . . 0 N--CA 1.485 1.315 0 CA-C-O 120.846 0.355 . . . . 0.0 111.213 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 182' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -58.31 -166.68 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.931 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 183' ' ' GLY . . . . . . . . . . . . . . . 166.69 63.63 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.722 -0.752 . . . . 0.0 112.419 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 184' ' ' TRP . . . . . . . . . . . . . 15.2 m95 -136.52 -51.3 0.69 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.738 0.304 . . . . 0.0 110.906 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 185' ' ' LYS . . . . . . . . . . . . . 13.8 tptm 63.54 -78.58 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.829 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 186' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -132.7 70.28 1.47 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.038 0.447 . . . . 0.0 110.699 179.903 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 187' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -60.65 -169.5 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.835 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 188' ' ' VAL . . . . . 0.676 HG13 ' CE1' ' B' ' 190' ' ' TYR . 1.5 t -79.67 125.01 38.55 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.305 0 CA-C-O 121.208 0.528 . . . . 0.0 111.561 -179.574 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 189' ' ' TYR . . . . . 0.709 ' CD1' HG22 ' A' ' 39' ' ' VAL . 0.1 OUTLIER -117.24 -13.78 10.47 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-N 115.373 -0.831 . . . . 0.0 111.549 -179.433 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 190' ' ' TYR . . . . . 0.676 ' CE1' HG13 ' B' ' 188' ' ' VAL . 48.4 p90 -89.41 -178.45 5.6 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.942 0.401 . . . . 0.0 111.927 -179.118 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 191' ' ' THR . . . . . 0.518 HG22 ' HA ' ' A' ' 7' ' ' ALA . 7.3 p -77.53 59.03 1.85 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.246 -179.852 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 192' ' ' CYS . . . . . 0.71 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.0 OUTLIER -48.23 174.89 0.01 OUTLIER 'General case' 0 CA--C 1.499 -0.993 0 CA-C-O 121.927 0.87 . . . . 0.0 111.756 179.829 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 193' ' ' CYS . . . . . 0.71 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.0 OUTLIER 46.51 82.13 0.24 Allowed Pre-proline 0 N--CA 1.44 -0.952 0 CA-C-N 113.598 -1.637 . . . . 0.0 112.043 173.602 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 194' ' ' PRO . . . . . 0.444 ' HA ' ' HB3' ' A' ' 10' ' ' PRO . 93.7 Cg_endo -83.54 52.5 3.86 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.899 2.399 . . . . 0.0 112.644 -179.763 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -178.5 110.72 0.06 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.883 0.373 . . . . 0.0 111.4 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 196' ' ' THR . . . . . 0.858 HG22 ' HG2' ' A' ' 10' ' ' PRO . 4.9 t -152.75 41.9 0.2 Allowed Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.648 179.698 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 197' ' ' PRO . . . . . 0.519 ' CD ' ' N ' ' B' ' 196' ' ' THR . 74.4 Cg_endo -72.77 11.47 0.85 Allowed 'Trans proline' 0 C--N 1.348 0.526 0 C-N-CA 121.607 1.538 . . . . 0.0 108.951 176.277 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 198' ' ' TYR . . . . . 0.58 ' H ' ' C ' ' B' ' 196' ' ' THR . 0.9 OUTLIER . . . . . 0 C--O 1.248 1.019 0 CA-C-N 113.9 -1.5 . . . . 0.0 111.153 -179.088 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . 0.408 HD12 ' N ' ' A' ' 1' ' ' ILE . 4.5 mp . . . . . 0 N--CA 1.486 1.363 0 CA-C-O 120.704 0.288 . . . . 0.0 111.055 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 1.036 HG22 HG22 ' A' ' 15' ' ' THR . 53.4 t 62.53 144.47 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.807 -179.925 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 14.5 p -117.48 24.67 10.95 Favored 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 113.34 0.866 . . . . 0.0 113.34 -178.079 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . 0.671 ' HA ' HG13 ' A' ' 14' ' ' VAL . 0.0 OUTLIER 68.07 162.7 0.2 Allowed 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 118.185 0.448 . . . . 0.0 110.073 -179.757 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.785 HG21 HG22 ' A' ' 11' ' ' ILE . 1.3 p -78.82 -161.96 0.34 Allowed 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 110.361 -0.237 . . . . 0.0 110.361 -179.95 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 16.9 p -74.98 53.7 0.62 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.769 0.319 . . . . 0.0 111.106 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.444 ' HB3' HG21 ' B' ' 191' ' ' THR . . . 48.24 -148.15 0.22 Allowed 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 116.484 -0.326 . . . . 0.0 110.897 179.894 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.597 HG22 ' HD2' ' A' ' 10' ' ' PRO . 0.2 OUTLIER 75.06 159.0 0.21 Allowed 'General case' 0 N--CA 1.461 0.099 0 CA-C-O 121.14 0.495 . . . . 0.0 111.324 179.585 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.634 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 1.5 p -72.42 -44.9 10.18 Favored Pre-proline 0 CA--C 1.533 0.319 0 CA-C-N 115.744 -0.662 . . . . 0.0 112.16 -179.773 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.634 ' HD2' ' N ' ' A' ' 9' ' ' SER . 47.9 Cg_endo -66.28 -32.48 41.66 Favored 'Trans proline' 0 C--N 1.35 0.626 0 C-N-CA 122.237 1.958 . . . . 0.0 112.652 -179.485 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.785 HG22 HG21 ' A' ' 5' ' ' THR . 2.3 mt 76.48 161.24 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.501 -179.638 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.466 ' N ' HG22 ' A' ' 11' ' ' ILE . 34.3 t -136.91 -120.41 0.15 Allowed 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 121.08 -0.248 . . . . 0.0 111.258 -179.644 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -100.17 123.25 44.19 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-O 120.779 0.323 . . . . 0.0 110.978 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.719 HG12 ' CG1' ' A' ' 2' ' ' VAL . 0.1 OUTLIER -84.47 172.1 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.239 -179.69 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 1.036 HG22 HG22 ' A' ' 2' ' ' VAL . 1.6 p 73.29 162.06 0.25 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.312 179.575 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.466 ' HB3' ' CD ' ' A' ' 17' ' ' PRO . 27.2 t -172.01 -60.05 0.0 OUTLIER Pre-proline 0 C--N 1.325 -0.461 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.34 179.867 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.466 ' CD ' ' HB3' ' A' ' 16' ' ' CYS . 19.5 Cg_endo -58.31 106.0 0.24 Allowed 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.382 2.055 . . . . 0.0 112.725 -179.656 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_exo -69.66 -52.81 0.31 Allowed 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.557 2.171 . . . . 0.0 111.399 179.376 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -112.82 -34.5 1.85 Allowed Glycine 0 N--CA 1.45 -0.377 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.999 179.54 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.445 ' HB2' HD12 ' A' ' 22' ' ' LEU . 0.0 OUTLIER -73.12 -175.6 1.88 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.786 0.327 . . . . 0.0 110.792 179.941 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 21.3 m-20 -123.78 -0.4 8.54 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.647 -179.885 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.591 HD22 ' HB2' ' A' ' 59' ' ' CYS . 0.1 OUTLIER -103.81 177.13 4.93 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.773 0.321 . . . . 0.0 110.917 -179.94 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.494 ' HA ' ' HA ' ' A' ' 44' ' ' CYS . 35.6 t -157.88 8.33 0.15 Allowed 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 -179.384 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.631 ' CE1' ' HB3' ' A' ' 45' ' ' ALA . 3.2 m-85 52.18 173.09 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 120.643 0.258 . . . . 0.0 111.001 -179.723 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.477 ' HB2' ' O ' ' A' ' 24' ' ' TYR . 0.6 OUTLIER 161.35 104.28 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.907 179.675 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.418 ' HD2' ' CB ' ' A' ' 41' ' ' GLU . 0.0 OUTLIER -58.0 -179.65 0.05 Allowed 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 178.932 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . 0.474 ' O ' ' O ' ' A' ' 28' ' ' TRP . 0.0 OUTLIER -146.04 44.75 1.25 Allowed 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.114 -0.635 . . . . 0.0 112.405 -179.522 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' TRP . . . . . 0.63 ' HB2' ' HA2' ' A' ' 37' ' ' GLY . 14.3 p-90 45.65 172.3 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 113.482 0.919 . . . . 0.0 113.482 178.28 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . 0.402 ' HB2' ' HE3' ' A' ' 28' ' ' TRP . 0.5 OUTLIER 37.1 -157.72 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 114.855 -1.066 . . . . 0.0 111.996 179.735 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 19.7 t0 -165.95 92.95 0.52 Allowed 'General case' 0 C--N 1.334 -0.096 0 CA-C-O 120.943 0.402 . . . . 0.0 111.206 -179.874 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . 62.79 140.13 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.709 179.578 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 17.6 t80 45.8 84.07 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 115.934 -0.576 . . . . 0.0 111.488 179.751 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 85.4 m -153.19 133.0 13.17 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.092 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -126.06 -44.21 1.77 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.752 179.888 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 1.2 m -93.13 -51.76 4.88 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.815 179.877 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 5.1 mpt_? -57.65 -170.15 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.728 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.63 ' HA2' ' HB2' ' A' ' 28' ' ' TRP . . . 105.07 -133.95 11.81 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.554 -0.831 . . . . 0.0 113.146 179.666 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.51 ' N ' ' HD3' ' A' ' 38' ' ' LYS . 0.0 OUTLIER 62.58 75.29 0.41 Allowed 'General case' 0 C--N 1.334 -0.085 0 CA-C-O 121.054 0.454 . . . . 0.0 110.914 -179.932 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.577 ' N ' ' HB3' ' A' ' 28' ' ' TRP . 17.5 t -157.47 160.61 2.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.511 -179.954 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.508 ' N ' HG12 ' A' ' 39' ' ' VAL . 35.4 m -157.98 175.93 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 116.4 -0.363 . . . . 0.0 110.601 179.912 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.418 ' CB ' ' HD2' ' A' ' 26' ' ' LYS . 0.1 OUTLIER 170.9 -179.08 0.05 OUTLIER 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 120.942 0.401 . . . . 0.0 111.321 179.678 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.634 HD23 ' H ' ' A' ' 42' ' ' LEU . 2.3 pt? -138.43 178.36 7.2 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.696 179.917 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.454 ' CA ' ' HB2' ' A' ' 24' ' ' TYR . . . -161.8 -58.52 0.02 OUTLIER Glycine 0 CA--C 1.518 0.233 0 C-N-CA 120.566 -0.826 . . . . 0.0 112.827 179.918 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.494 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 0.9 OUTLIER 66.88 90.18 0.1 Allowed 'General case' 0 C--O 1.232 0.139 0 CA-C-O 121.034 0.445 . . . . 0.0 110.862 -179.783 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.631 ' HB3' ' CE1' ' A' ' 24' ' ' TYR . . . -128.08 -165.04 1.44 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.897 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -141.51 55.52 1.52 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.953 0.406 . . . . 0.0 110.977 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.52 HG23 ' HD2' ' A' ' 49' ' ' PRO . 4.0 t -175.12 137.66 0.41 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.631 -179.823 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.738 ' N ' ' HD3' ' A' ' 49' ' ' PRO . 56.5 m -118.54 30.43 0.15 Allowed Pre-proline 0 CA--C 1.537 0.479 0 N-CA-C 113.3 0.852 . . . . 0.0 113.3 -179.664 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.738 ' HD3' ' N ' ' A' ' 48' ' ' CYS . 36.3 Cg_exo -59.05 -16.57 33.59 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 121.703 1.602 . . . . 0.0 111.971 179.068 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 6.6 t -38.17 131.71 1.11 Allowed 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.78 -179.614 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 23.0 mtmm -166.59 -38.98 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.092 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.51 ' H ' ' HD2' ' A' ' 53' ' ' PRO . 0.0 OUTLIER -117.81 -67.24 0.02 OUTLIER Pre-proline 0 CA--C 1.533 0.299 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.785 -179.416 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . 0.51 ' HD2' ' H ' ' A' ' 52' ' ' LYS . 21.8 Cg_endo -60.45 -85.43 0.01 OUTLIER 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.137 1.891 . . . . 0.0 112.534 -179.43 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . 0.452 ' HB3' HG21 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -66.64 80.5 0.1 Allowed 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 120.9 0.381 . . . . 0.0 110.673 -179.962 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -78.99 -78.51 0.15 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.224 -179.636 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -57.08 -21.75 34.18 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.401 -179.571 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.453 ' CG1' ' CD2' ' A' ' 24' ' ' TYR . 61.4 t -54.63 -60.95 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 120.851 0.357 . . . . 0.0 111.003 179.743 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 59.66 111.83 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.693 -179.917 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . 0.591 ' HB2' HD22 ' A' ' 22' ' ' LEU . 9.1 p -46.39 -30.17 2.01 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.361 -0.382 . . . . 0.0 111.064 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.501 ' O ' ' CB ' ' A' ' 61' ' ' SER . 0.0 OUTLIER 74.16 172.7 0.28 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.748 179.939 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.501 ' CB ' ' O ' ' A' ' 60' ' ' CYS . 2.8 p 154.06 68.3 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.557 -179.814 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -161.78 173.44 14.61 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.041 -179.899 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -68.85 -42.2 77.43 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.811 179.901 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.437 ' HD2' ' CD2' ' A' ' 4' ' ' HIS . 40.5 mmtm -116.76 84.31 2.12 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.719 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -73.19 -27.09 61.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.178 -179.883 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -128.23 74.09 79.58 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.072 -179.883 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 15.3 Cg_exo -68.57 67.57 1.13 Allowed 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.803 2.335 . . . . 0.0 112.335 -179.817 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 2.5 m-70 61.7 153.94 0.11 Allowed Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.032 179.774 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -59.18 -162.22 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.675 2.25 . . . . 0.0 112.19 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.539 ' O ' ' C ' ' A' ' 71' ' ' GLN . 0.0 OUTLIER -121.91 -33.19 3.6 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.491 179.833 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.539 ' C ' ' O ' ' A' ' 70' ' ' LYS . 1.8 tt0 -4.03 79.53 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 112.785 0.661 . . . . 0.0 112.785 179.908 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.541 ' NE ' ' HA ' ' A' ' 72' ' ' ARG . 0.0 OUTLIER 142.98 158.48 0.0 OUTLIER Pre-proline 0 N--CA 1.472 0.673 0 C-N-CA 123.896 0.879 . . . . 0.0 110.075 179.83 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -50.32 -52.85 8.13 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 122.557 2.172 . . . . 0.0 112.374 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.125 0 CA-C-O 118.373 -1.237 . . . . 0.0 112.494 -179.997 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 181' ' ' TYR . . . . . . . . . . . . . 36.6 m-85 . . . . . 0 N--CA 1.487 1.378 0 CA-C-O 120.825 0.345 . . . . 0.0 111.109 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 182' ' ' ARG . . . . . . . . . . . . . 30.5 ttt180 -96.03 -40.73 9.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.793 179.921 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 183' ' ' GLY . . . . . . . . . . . . . . . 104.59 26.38 6.51 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.525 179.941 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 184' ' ' TRP . . . . . . . . . . . . . 19.1 t90 68.46 -64.93 0.29 Allowed 'General case' 0 C--O 1.232 0.175 0 CA-C-O 120.749 0.309 . . . . 0.0 111.144 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 185' ' ' LYS . . . . . . . . . . . . . 4.9 tttt 72.19 130.67 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.801 -179.878 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 186' ' ' HIS . . . . . . . . . . . . . 56.3 p-80 -87.14 156.4 19.72 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.07 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 187' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -89.98 -164.62 1.19 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.727 179.902 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 188' ' ' VAL . . . . . 0.467 ' CG1' ' CE1' ' B' ' 190' ' ' TYR . 0.2 OUTLIER -79.91 165.94 2.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.021 -179.912 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 189' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -115.4 48.37 1.19 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.903 0.382 . . . . 0.0 111.175 -179.805 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 190' ' ' TYR . . . . . 0.467 ' CE1' ' CG1' ' B' ' 188' ' ' VAL . 3.4 m-30 -87.66 116.21 25.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.259 179.595 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 191' ' ' THR . . . . . 0.62 ' O ' HG22 ' B' ' 191' ' ' THR . 53.8 m -90.18 60.01 4.65 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.922 0.392 . . . . 0.0 111.318 -179.591 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 192' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -90.38 -65.85 0.98 Allowed 'General case' 0 CA--C 1.502 -0.899 0 CA-C-O 122.23 1.014 . . . . 0.0 111.557 179.549 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 193' ' ' CYS . . . . . 0.583 ' N ' ' CD ' ' B' ' 194' ' ' PRO . 0.5 OUTLIER -144.12 35.29 0.19 Allowed Pre-proline 0 N--CA 1.43 -1.475 0 CA-C-N 113.025 -1.898 . . . . 0.0 112.826 -172.851 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 194' ' ' PRO . . . . . 0.583 ' CD ' ' N ' ' B' ' 193' ' ' CYS . 92.6 Cg_endo -79.89 -34.31 0.96 Allowed 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 122.312 2.008 . . . . 0.0 112.454 179.821 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 195' ' ' ASP . . . . . 0.416 ' C ' ' HD3' ' B' ' 197' ' ' PRO . 36.9 t70 -112.64 39.8 2.41 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.402 -179.531 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 196' ' ' THR . . . . . 0.753 ' N ' ' HD3' ' B' ' 197' ' ' PRO . 15.1 t -112.4 21.78 0.08 OUTLIER Pre-proline 0 CA--C 1.531 0.245 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 179.914 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 197' ' ' PRO . . . . . 0.753 ' HD3' ' N ' ' B' ' 196' ' ' THR . 8.0 Cg_exo -67.36 16.4 0.12 Allowed 'Trans proline' 0 C--N 1.357 1.025 0 CA-C-N 120.427 1.188 . . . . 0.0 109.593 176.304 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 198' ' ' TYR . . . . . 0.681 ' H ' ' C ' ' B' ' 196' ' ' THR . 38.4 t80 . . . . . 0 C--O 1.25 1.106 0 CA-C-N 114.554 -1.203 . . . . 0.0 111.23 -178.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . 0.443 HG22 ' HG2' ' A' ' 64' ' ' LYS . 6.8 mm . . . . . 0 N--CA 1.487 1.381 0 CA-C-O 120.822 0.344 . . . . 0.0 111.009 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.534 ' C ' ' HG3' ' A' ' 64' ' ' LYS . 95.8 t -129.35 138.44 54.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.565 179.602 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.51 ' N ' ' HG3' ' A' ' 64' ' ' LYS . 1.3 m -84.11 -174.56 5.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.507 -178.891 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . 0.453 ' CG ' ' ND2' ' A' ' 66' ' ' ASN . 0.0 OUTLIER -149.05 127.08 11.95 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.236 179.648 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -45.99 -50.19 15.18 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.151 -179.82 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.573 ' CB ' HD12 ' A' ' 42' ' ' LEU . 21.8 m 47.34 28.1 1.01 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.92 179.471 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.39 -70.1 0.19 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.057 0.456 . . . . 0.0 110.535 179.546 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 1.1 p -135.35 24.93 3.5 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.133 179.238 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.445 ' HB3' ' HB2' ' B' ' 195' ' ' ASP . 0.1 OUTLIER 172.66 169.24 0.24 Allowed Pre-proline 0 C--N 1.332 -0.155 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.116 -179.649 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.451 ' O ' ' N ' ' A' ' 12' ' ' SER . 11.2 Cg_endo -53.47 -79.78 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 122.32 2.013 . . . . 0.0 112.007 179.898 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 32.7 mm 61.22 -75.46 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-O 120.683 0.278 . . . . 0.0 111.502 179.737 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.583 ' O ' ' HB3' ' A' ' 13' ' ' ALA . 0.7 OUTLIER 64.81 -162.18 0.27 Allowed 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.801 -179.903 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.583 ' HB3' ' O ' ' A' ' 12' ' ' SER . . . 80.72 -4.21 1.79 Allowed 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.705 -179.911 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.467 HG23 ' N ' ' A' ' 15' ' ' THR . 15.0 m -48.41 -48.38 13.98 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.094 0 CA-C-O 120.792 0.33 . . . . 0.0 110.788 179.657 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.5 HG22 HG13 ' A' ' 2' ' ' VAL . 9.1 p 44.67 101.78 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.994 179.206 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.437 ' CB ' ' HD2' ' A' ' 17' ' ' PRO . 0.8 OUTLIER -91.05 167.06 16.87 Favored Pre-proline 0 C--N 1.327 -0.407 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.636 179.684 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.437 ' HD2' ' CB ' ' A' ' 16' ' ' CYS . 3.4 Cg_exo -40.73 150.08 0.14 Allowed 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 123.094 2.529 . . . . 0.0 112.83 -179.736 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -59.16 -60.54 0.32 Allowed 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.841 2.36 . . . . 0.0 112.826 -179.596 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -58.84 -141.26 0.01 OUTLIER Glycine 0 CA--C 1.518 0.261 0 CA-C-N 116.004 -0.544 . . . . 0.0 113.116 -179.262 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -57.11 -163.74 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.751 0.31 . . . . 0.0 111.234 -179.672 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 4.8 m120 74.23 69.54 0.1 Allowed 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.764 -179.856 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.43 HD13 ' HZ3' ' A' ' 64' ' ' LYS . 3.4 mm? -86.41 178.85 6.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.961 -179.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.539 ' HA ' ' HA ' ' A' ' 44' ' ' CYS . 0.8 OUTLIER -55.01 171.44 0.14 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.098 0.475 . . . . 0.0 111.855 -179.266 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.85 ' CD1' ' HB2' ' A' ' 45' ' ' ALA . 0.0 OUTLIER -109.61 -162.55 0.81 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.731 -179.655 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -165.88 69.2 0.12 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.962 179.695 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.803 ' HD3' HG23 ' A' ' 57' ' ' VAL . 11.6 tptm -95.39 62.44 2.44 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.814 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . 0.584 ' HG3' HG13 ' A' ' 39' ' ' VAL . 6.4 ttt -97.09 90.59 5.21 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' TRP . . . . . 0.853 ' CB ' HG21 ' A' ' 39' ' ' VAL . 10.7 t-105 -39.78 -86.5 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 -178.948 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . 0.459 ' N ' HG11 ' A' ' 39' ' ' VAL . 10.4 t 72.76 154.01 0.14 Allowed 'General case' 0 N--CA 1.462 0.172 0 CA-C-O 120.691 0.282 . . . . 0.0 110.513 -179.554 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -121.29 111.61 17.58 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.869 0.366 . . . . 0.0 111.367 -179.596 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . 57.15 -86.39 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.348 179.683 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 6.3 p90 -108.15 131.31 54.77 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.896 0.379 . . . . 0.0 110.805 -179.845 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -86.44 -166.23 1.49 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.904 -179.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 76.42 99.37 0.07 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.354 -179.551 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 4.7 p 60.83 32.12 20.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.539 -179.51 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 9.1 tpt85 -96.1 -84.99 0.34 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.214 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -123.4 -14.63 3.93 Favored Glycine 0 C--N 1.334 0.459 0 C-N-CA 120.388 -0.91 . . . . 0.0 113.56 -179.504 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.475 ' HA ' ' HG3' ' A' ' 70' ' ' LYS . 0.0 OUTLIER 59.46 58.58 2.91 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 117.188 0.494 . . . . 0.0 110.434 -179.621 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.853 HG21 ' CB ' ' A' ' 28' ' ' TRP . 9.1 p -82.09 145.61 8.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.671 -179.324 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 1.061 HG12 HG23 ' B' ' 191' ' ' THR . 3.2 m -81.33 163.96 3.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 N-CA-C 112.304 0.483 . . . . 0.0 112.304 -179.796 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.465 ' HB2' ' N ' ' A' ' 26' ' ' LYS . 1.6 pt-20 -153.43 -154.03 0.5 Allowed 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 115.085 -0.962 . . . . 0.0 109.964 -179.371 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.573 HD12 ' CB ' ' A' ' 6' ' ' THR . 37.9 mt 66.75 136.03 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 121.069 0.462 . . . . 0.0 111.655 179.46 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 176.75 14.13 0.02 OUTLIER Glycine 0 CA--C 1.525 0.672 0 C-N-CA 120.863 -0.684 . . . . 0.0 113.584 179.589 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.539 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 1.3 m 61.06 150.42 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 117.379 0.589 . . . . 0.0 111.222 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.85 ' HB2' ' CD1' ' A' ' 24' ' ' TYR . . . -135.2 -167.74 2.06 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.481 -179.445 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -114.78 -28.33 7.12 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.899 179.527 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.723 HG23 ' HD3' ' A' ' 49' ' ' PRO . 1.8 t -158.09 -120.49 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.464 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.423 ' N ' ' OG1' ' A' ' 47' ' ' THR . 2.1 t -178.01 65.19 0.19 Allowed Pre-proline 0 C--O 1.231 0.119 0 CA-C-O 120.812 0.339 . . . . 0.0 111.103 -179.921 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.723 ' HD3' HG23 ' A' ' 47' ' ' THR . 96.4 Cg_endo -78.78 14.33 1.71 Allowed 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.575 2.184 . . . . 0.0 111.544 178.811 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 31.5 t -61.0 135.71 57.87 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.584 -0.734 . . . . 0.0 111.415 -179.608 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 6.4 pttt 171.15 44.15 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.687 179.72 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.56 165.63 17.16 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.875 -179.87 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_exo -60.03 -68.08 0.05 OUTLIER 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 122.562 2.175 . . . . 0.0 112.339 -179.831 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -69.28 99.61 1.2 Allowed 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.53 179.948 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.498 ' HB3' HG23 ' A' ' 58' ' ' THR . 3.7 mm-40 -109.96 -107.7 0.35 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.241 -179.554 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.751 ' O ' HG23 ' A' ' 57' ' ' VAL . 0.4 OUTLIER 60.63 64.57 1.16 Allowed 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 120.827 0.346 . . . . 0.0 110.513 -179.825 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.803 HG23 ' HD3' ' A' ' 26' ' ' LYS . 0.9 OUTLIER 164.89 -30.54 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.286 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.192 -179.509 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.498 HG23 ' HB3' ' A' ' 55' ' ' GLU . 71.9 p -33.72 157.89 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 115.616 -0.72 . . . . 0.0 112.512 -179.417 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 2.6 p -51.96 -173.79 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.919 -179.509 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.402 ' HB3' ' CB ' ' A' ' 23' ' ' CYS . 0.6 OUTLIER -163.56 70.08 0.22 Allowed 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.616 179.992 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.564 ' O ' ' HB ' ' A' ' 62' ' ' THR . 9.7 p -88.21 128.68 35.46 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.6 -179.492 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.564 ' HB ' ' O ' ' A' ' 61' ' ' SER . 6.0 t 144.41 -146.13 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 108.458 -0.942 . . . . 0.0 108.458 -179.758 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . 0.425 ' N ' ' OG1' ' A' ' 62' ' ' THR . 19.9 m-20 -74.38 55.39 0.62 Allowed 'General case' 0 C--N 1.332 -0.196 0 N-CA-C 109.684 -0.488 . . . . 0.0 109.684 178.581 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.534 ' HG3' ' C ' ' A' ' 2' ' ' VAL . 1.7 mmtp 36.05 45.46 0.31 Allowed 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 115.387 -0.824 . . . . 0.0 112.479 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . 0.471 ' HB2' ' HD3' ' A' ' 67' ' ' PRO . 0.0 OUTLIER 50.19 -82.63 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 115.481 -0.781 . . . . 0.0 112.301 178.651 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.475 ' N ' ' HD3' ' A' ' 67' ' ' PRO . 1.0 OUTLIER 52.98 57.61 14.56 Favored Pre-proline 0 CA--C 1.532 0.283 0 CA-C-O 120.752 0.311 . . . . 0.0 111.178 -179.589 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . 0.475 ' HD3' ' N ' ' A' ' 66' ' ' ASN . 63.8 Cg_endo -92.38 18.3 1.11 Allowed 'Trans proline' 0 N--CA 1.458 -0.616 0 C-N-CA 122.98 2.453 . . . . 0.0 113.142 -179.552 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.413 ' HB3' ' HD2' ' A' ' 69' ' ' PRO . 79.7 m80 60.83 158.63 0.11 Allowed Pre-proline 0 C--N 1.33 -0.243 0 CA-C-N 116.698 -0.228 . . . . 0.0 110.65 -179.793 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.676 ' HB3' HG22 ' B' ' 191' ' ' THR . 58.8 Cg_endo -71.82 64.12 3.18 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.424 2.082 . . . . 0.0 112.506 -179.706 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.515 ' O ' ' N ' ' A' ' 72' ' ' ARG . 2.4 mmmm 50.67 -87.66 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.174 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.446 ' N ' ' O ' ' A' ' 69' ' ' PRO . 8.2 tp-100 52.21 -80.78 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.173 0 CA-C-N 116.641 -0.254 . . . . 0.0 111.682 179.409 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.515 ' N ' ' O ' ' A' ' 70' ' ' LYS . 1.0 OUTLIER -44.25 110.1 0.95 Allowed Pre-proline 0 CA--C 1.531 0.224 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.246 179.982 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_exo -56.94 -162.09 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.523 2.149 . . . . 0.0 112.311 -179.872 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.111 0 CA-C-O 118.371 -1.238 . . . . 0.0 112.511 -179.951 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 181' ' ' TYR . . . . . . . . . . . . . 7.7 p90 . . . . . 0 N--CA 1.487 1.414 0 CA-C-O 120.82 0.343 . . . . 0.0 111.163 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 182' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.78 80.03 4.25 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.908 -179.977 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 183' ' ' GLY . . . . . . . . . . . . . . . -99.51 32.72 6.86 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.346 179.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 184' ' ' TRP . . . . . . . . . . . . . 5.1 m95 -111.1 -160.99 0.73 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.644 0.259 . . . . 0.0 110.794 -179.849 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 185' ' ' LYS . . . . . . . . . . . . . 1.7 tttm 64.64 142.01 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.87 0.367 . . . . 0.0 111.004 179.923 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 186' ' ' HIS . . . . . . . . . . . . . 3.8 m170 -103.25 172.07 7.02 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.866 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 187' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -89.98 -178.42 5.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.82 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 188' ' ' VAL . . . . . 0.411 ' H ' HG23 ' B' ' 188' ' ' VAL . 0.2 OUTLIER -79.96 -44.99 22.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.708 179.938 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 189' ' ' TYR . . . . . 0.735 ' HA ' HG23 ' A' ' 39' ' ' VAL . 0.1 OUTLIER -79.56 129.79 34.79 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.967 179.978 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 190' ' ' TYR . . . . . 0.447 ' H ' HG13 ' A' ' 40' ' ' VAL . 0.2 OUTLIER -156.63 15.91 0.31 Allowed 'General case' 0 CA--C 1.53 0.189 0 N-CA-C 112.924 0.713 . . . . 0.0 112.924 -179.87 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 191' ' ' THR . . . . . 1.061 HG23 HG12 ' A' ' 40' ' ' VAL . 0.0 OUTLIER -90.34 81.57 6.03 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.853 0.359 . . . . 0.0 110.74 179.477 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 192' ' ' CYS . . . . . 0.701 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.5 OUTLIER -90.41 -57.6 2.78 Favored 'General case' 0 CA--C 1.497 -1.059 0 CA-C-O 122.045 0.926 . . . . 0.0 111.473 -179.92 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 193' ' ' CYS . . . . . 0.701 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.0 OUTLIER -155.3 166.7 15.64 Favored Pre-proline 0 N--CA 1.435 -1.203 0 CA-C-N 113.44 -1.709 . . . . 0.0 111.574 -173.647 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 194' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -74.23 -162.41 0.14 Allowed 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.613 2.208 . . . . 0.0 112.365 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 195' ' ' ASP . . . . . 0.445 ' HB2' ' HB3' ' A' ' 9' ' ' SER . 36.9 t70 -133.64 58.52 1.77 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.249 179.622 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 196' ' ' THR . . . . . 0.733 ' N ' ' HD3' ' B' ' 197' ' ' PRO . 16.0 p -101.82 12.13 0.06 OUTLIER Pre-proline 0 CA--C 1.534 0.347 0 N-CA-C 113.893 1.072 . . . . 0.0 113.893 -179.508 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 197' ' ' PRO . . . . . 0.733 ' HD3' ' N ' ' B' ' 196' ' ' THR . 13.5 Cg_exo -66.47 22.78 0.1 OUTLIER 'Trans proline' 0 C--N 1.359 1.116 0 CA-C-N 121.014 1.398 . . . . 0.0 109.934 176.85 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 198' ' ' TYR . . . . . 0.721 ' H ' ' C ' ' B' ' 196' ' ' THR . 35.4 t80 . . . . . 0 C--O 1.248 1.011 0 CA-C-N 114.584 -1.189 . . . . 0.0 111.281 -178.797 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . 0.42 ' CG1' ' HA ' ' A' ' 63' ' ' ASP . 1.0 OUTLIER . . . . . 0 N--CA 1.487 1.38 0 CA-C-O 120.396 0.141 . . . . 0.0 110.924 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.62 ' CG2' HG22 ' A' ' 15' ' ' THR . 84.1 t -42.49 159.7 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.462 0.171 0 CA-C-O 120.528 0.204 . . . . 0.0 111.29 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.507 ' N ' HG12 ' A' ' 2' ' ' VAL . 49.7 t -158.06 41.89 0.28 Allowed 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 112.582 0.586 . . . . 0.0 112.582 -178.716 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . 0.752 ' HA ' HG12 ' A' ' 14' ' ' VAL . 0.1 OUTLIER 49.95 -176.91 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.82 0.343 . . . . 0.0 111.687 179.105 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 17.1 p -63.55 -132.05 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.7 179.782 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.417 HG22 ' HB3' ' A' ' 42' ' ' LEU . 6.4 p -96.15 30.84 2.33 Favored 'General case' 0 CA--C 1.528 0.121 0 CA-C-O 120.812 0.339 . . . . 0.0 111.106 -179.857 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 60.93 52.75 4.02 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.911 0.386 . . . . 0.0 111.098 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 25.5 p -96.35 -164.46 1.16 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.721 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.475 ' CB ' ' CD ' ' A' ' 10' ' ' PRO . 0.6 OUTLIER -74.09 -67.35 0.41 Allowed Pre-proline 0 C--N 1.332 -0.181 0 CA-C-N 116.676 -0.238 . . . . 0.0 110.872 -179.981 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.509 ' O ' HG23 ' A' ' 11' ' ' ILE . 49.1 Cg_endo -79.28 -129.59 0.01 OUTLIER 'Trans proline' 0 CA--C 1.535 0.536 0 C-N-CA 122.396 2.064 . . . . 0.0 111.723 179.856 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.509 HG23 ' O ' ' A' ' 10' ' ' PRO . 19.9 pt -159.02 160.66 1.83 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.096 0 CA-C-O 120.625 0.25 . . . . 0.0 110.582 179.846 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 69.8 m -140.5 -84.35 0.22 Allowed 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.963 -0.295 . . . . 0.0 111.358 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -137.37 87.28 2.26 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.803 0.335 . . . . 0.0 110.976 -179.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 1.01 HG23 HG23 ' A' ' 15' ' ' THR . 11.9 m -54.12 172.62 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.321 -179.876 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 1.01 HG23 HG23 ' A' ' 14' ' ' VAL . 1.1 p 72.11 150.46 0.1 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.129 179.737 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 4.5 m -112.49 116.34 48.49 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.8 179.757 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.453 ' N ' ' CD ' ' A' ' 18' ' ' PRO . 37.1 Cg_exo -58.68 -47.58 18.19 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.216 1.944 . . . . 0.0 112.378 179.787 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.453 ' CD ' ' N ' ' A' ' 17' ' ' PRO . 77.2 Cg_endo -87.16 174.22 5.39 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 122.742 2.295 . . . . 0.0 112.471 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 52.98 -167.06 1.19 Allowed Glycine 0 C--N 1.331 0.276 0 C-N-CA 120.913 -0.66 . . . . 0.0 112.855 179.795 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.62 ' HB2' ' HB2' ' A' ' 46' ' ' ALA . 0.3 OUTLIER -100.21 -153.81 0.46 Allowed 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 110.449 -0.204 . . . . 0.0 110.449 179.813 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.436 ' C ' HD22 ' A' ' 22' ' ' LEU . 28.9 p-10 -106.19 64.8 0.68 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.748 0.308 . . . . 0.0 111.541 -179.574 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.557 HD13 ' CB ' ' A' ' 61' ' ' SER . 4.1 mm? -112.89 7.57 18.35 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.295 179.541 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.708 ' HB3' ' HB3' ' A' ' 60' ' ' CYS . 40.0 t 24.19 43.69 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.477 0.711 . . . . 0.0 112.623 179.867 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.651 ' CE2' HG11 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -36.32 91.52 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.87 178.733 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.465 ' N ' ' O ' ' A' ' 23' ' ' CYS . 2.0 ptt180 -97.18 98.62 10.18 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.883 0.373 . . . . 0.0 111.28 -179.242 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.73 ' HG3' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -68.53 177.4 2.45 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.088 -0.505 . . . . 0.0 109.713 179.195 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 18.1 ttp -176.77 164.47 2.41 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.806 0.336 . . . . 0.0 110.703 179.812 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' TRP . . . . . 0.777 ' CB ' HG21 ' A' ' 39' ' ' VAL . 2.4 t90 -105.74 -137.15 0.36 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.279 179.828 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 71.15 -162.73 0.14 Allowed 'General case' 0 CA--C 1.529 0.165 0 CA-C-O 120.682 0.277 . . . . 0.0 110.558 -179.912 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.538 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 0.1 OUTLIER 173.72 37.36 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.96 179.875 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.538 ' HB3' ' O ' ' A' ' 30' ' ' ASP . . . 76.29 -54.52 0.6 Allowed 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.498 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -46.24 -28.71 1.35 Allowed 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 111.815 0.302 . . . . 0.0 111.815 -179.591 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -83.84 133.81 34.73 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.87 0.367 . . . . 0.0 110.62 179.784 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 74.2 p -64.42 76.93 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.313 -179.638 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 29.6 t 49.15 59.9 4.13 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.287 179.695 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.406 ' C ' ' HD3' ' A' ' 38' ' ' LYS . 4.9 mmm-85 -101.98 -107.53 0.24 Allowed 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.686 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.618 ' O ' HG23 ' A' ' 39' ' ' VAL . . . 76.22 -95.38 1.06 Allowed Glycine 0 C--N 1.335 0.482 0 C-N-CA 120.607 -0.806 . . . . 0.0 113.115 179.745 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.64 ' HG2' ' O ' ' B' ' 189' ' ' TYR . 0.0 OUTLIER 38.72 30.39 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 112.615 0.598 . . . . 0.0 112.615 -179.574 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.805 HG22 ' CA ' ' B' ' 189' ' ' TYR . 4.5 t -96.46 7.26 7.63 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-O 120.844 0.354 . . . . 0.0 110.589 178.212 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.835 HG22 ' OG1' ' B' ' 191' ' ' THR . 4.8 m 25.4 -145.83 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.657 0 C-N-CA 123.707 0.803 . . . . 0.0 113.097 179.202 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.627 ' N ' HG23 ' A' ' 40' ' ' VAL . 0.1 OUTLIER 118.67 106.86 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.082 0.953 . . . . 0.0 110.183 -179.535 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.417 ' HB3' HG22 ' A' ' 6' ' ' THR . 0.5 OUTLIER -50.7 179.84 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.396 -179.673 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.617 ' HA3' ' HB3' ' A' ' 24' ' ' TYR . . . -179.43 -78.37 0.06 OUTLIER Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.292 -0.956 . . . . 0.0 113.259 179.907 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.515 ' H ' ' N ' ' A' ' 24' ' ' TYR . 0.5 OUTLIER 55.44 79.34 0.16 Allowed 'General case' 0 CA--C 1.531 0.221 0 CA-C-O 120.764 0.316 . . . . 0.0 110.684 -179.29 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.436 ' HB3' ' CD1' ' A' ' 24' ' ' TYR . . . -96.52 -160.7 0.81 Allowed 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.492 -179.51 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.62 ' HB2' ' HB2' ' A' ' 20' ' ' GLU . . . -167.28 50.41 0.06 Allowed 'General case' 0 C--N 1.333 -0.115 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.452 -179.705 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.79 HG23 ' HD3' ' A' ' 49' ' ' PRO . 0.0 OUTLIER 178.41 -33.2 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.137 179.871 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.604 ' N ' ' HD3' ' A' ' 49' ' ' PRO . 85.5 m 68.66 34.32 0.1 Allowed Pre-proline 0 CA--C 1.534 0.341 0 N-CA-C 113.519 0.933 . . . . 0.0 113.519 179.135 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.79 ' HD3' HG23 ' A' ' 47' ' ' THR . 44.1 Cg_endo -88.88 13.97 2.37 Favored 'Trans proline' 0 C--N 1.35 0.608 0 C-N-CA 122.08 1.853 . . . . 0.0 110.894 178.106 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.493 ' O ' ' HB2' ' A' ' 51' ' ' LYS . 0.3 OUTLIER -97.05 42.33 1.09 Allowed 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 115.247 -0.888 . . . . 0.0 111.547 -178.726 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.493 ' HB2' ' O ' ' A' ' 50' ' ' SER . 12.5 mttt 74.56 162.53 0.26 Allowed 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.667 -179.638 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.584 ' HB2' ' CD ' ' A' ' 53' ' ' PRO . 0.1 OUTLIER -128.72 -70.51 0.02 OUTLIER Pre-proline 0 CA--C 1.534 0.363 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.891 -179.602 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . 0.584 ' CD ' ' HB2' ' A' ' 52' ' ' LYS . 36.8 Cg_endo -66.67 -61.94 0.08 OUTLIER 'Trans proline' 0 C--N 1.352 0.715 0 C-N-CA 121.987 1.791 . . . . 0.0 112.9 -179.641 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . 0.448 ' CE1' ' HG2' ' A' ' 53' ' ' PRO . 0.0 OUTLIER -52.38 178.8 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 120.916 0.389 . . . . 0.0 111.649 -179.573 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 41.65 -112.25 0.17 Allowed 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.558 -179.684 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.492 ' O ' ' N ' ' A' ' 58' ' ' THR . 43.1 mm-40 -162.49 -112.62 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 110.225 -0.287 . . . . 0.0 110.225 -179.738 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.73 HG22 ' HG3' ' A' ' 26' ' ' LYS . 21.6 t 58.19 -76.38 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.231 0.094 0 CA-C-O 120.816 0.341 . . . . 0.0 111.574 179.526 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.492 ' N ' ' O ' ' A' ' 56' ' ' GLU . 45.1 p 51.78 26.37 3.47 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.045 -179.722 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . 0.636 ' H ' HG12 ' A' ' 57' ' ' VAL . 2.5 m 50.78 -177.3 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.814 -179.759 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.708 ' HB3' ' HB3' ' A' ' 23' ' ' CYS . 2.2 t -141.19 -94.81 0.14 Allowed 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 116.635 -0.257 . . . . 0.0 110.862 -179.858 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.557 ' CB ' HD13 ' A' ' 22' ' ' LEU . 1.6 t 54.25 172.75 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.164 0 CA-C-O 120.892 0.377 . . . . 0.0 111.56 179.394 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.402 ' N ' ' OG ' ' A' ' 61' ' ' SER . 1.2 m 74.64 79.07 0.11 Allowed 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.243 179.679 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . 0.42 ' HA ' ' CG1' ' A' ' 1' ' ' ILE . 11.5 m-20 52.36 -178.39 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.972 179.881 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.438 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 0.0 OUTLIER -57.35 88.79 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.683 179.851 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 3.2 p -92.13 42.56 1.11 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.466 -179.825 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.417 ' O ' ' CD2' ' A' ' 68' ' ' HIS . 2.3 m-20 -106.67 87.46 2.81 Favored Pre-proline 0 C--N 1.326 -0.433 0 C-N-CA 120.897 -0.321 . . . . 0.0 110.651 179.582 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -73.03 -4.6 15.71 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.727 2.285 . . . . 0.0 113.069 -179.64 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.441 ' HB3' ' HD2' ' A' ' 69' ' ' PRO . 0.3 OUTLIER 64.29 178.56 0.05 OUTLIER Pre-proline 0 C--N 1.331 -0.221 0 N-CA-C 110.396 -0.224 . . . . 0.0 110.396 -179.763 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.441 ' HD2' ' HB3' ' A' ' 68' ' ' HIS . 77.7 Cg_exo -50.24 123.22 10.67 Favored 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.377 2.051 . . . . 0.0 112.479 -179.84 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.28 29.97 2.99 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.919 179.868 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.415 ' HB3' ' CE ' ' A' ' 38' ' ' LYS . 1.5 pp0? -63.51 -39.85 95.52 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.068 -179.857 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 3.3 mmp_? 57.75 98.18 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.995 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -67.3 68.63 0.66 Allowed 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 122.408 2.072 . . . . 0.0 112.29 -179.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.41 -1.217 . . . . 0.0 112.386 -179.959 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 181' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.527 0 CA-C-O 120.769 0.319 . . . . 0.0 111.013 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 182' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -158.9 151.09 21.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.957 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 183' ' ' GLY . . . . . . . . . . . . . . . -159.85 149.03 18.36 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.479 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 184' ' ' TRP . . . . . 0.402 ' CD1' ' N ' ' B' ' 184' ' ' TRP . 0.1 OUTLIER -176.66 170.18 2.45 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.937 0.399 . . . . 0.0 111.034 179.987 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 185' ' ' LYS . . . . . 0.446 ' HD2' ' CD2' ' B' ' 186' ' ' HIS . 0.2 OUTLIER -67.23 -80.6 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.736 179.813 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 186' ' ' HIS . . . . . 0.592 ' CE1' HG23 ' B' ' 191' ' ' THR . 25.5 p80 -139.32 -157.77 0.8 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.414 179.857 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 187' ' ' TRP . . . . . . . . . . . . . 4.8 m0 -47.66 172.2 0.01 OUTLIER 'General case' 0 CA--C 1.528 0.123 0 CA-C-O 120.833 0.349 . . . . 0.0 111.068 179.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 2.4 t -78.91 -113.99 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.465 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.959 -179.457 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 189' ' ' TYR . . . . . 0.805 ' CA ' HG22 ' A' ' 39' ' ' VAL . 0.4 OUTLIER -79.59 51.09 1.21 Allowed 'General case' 0 N--CA 1.453 -0.312 0 O-C-N 122.223 -0.298 . . . . 0.0 111.274 -179.892 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 190' ' ' TYR . . . . . 0.476 ' HA ' ' O ' ' A' ' 38' ' ' LYS . 9.1 t80 -154.43 87.72 1.19 Allowed 'General case' 0 CA--C 1.516 -0.353 0 CA-C-O 121.425 0.631 . . . . 0.0 110.892 179.84 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 191' ' ' THR . . . . . 0.835 ' OG1' HG22 ' A' ' 40' ' ' VAL . 0.0 OUTLIER -91.25 -50.02 6.05 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 115.015 -0.993 . . . . 0.0 111.495 -179.873 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 192' ' ' CYS . . . . . 0.714 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.0 OUTLIER -43.48 171.52 0.0 OUTLIER 'General case' 0 CA--C 1.498 -1.043 0 CA-C-O 122.284 1.04 . . . . 0.0 112.038 -179.448 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 193' ' ' CYS . . . . . 0.714 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.0 OUTLIER 44.72 49.79 6.35 Favored Pre-proline 0 N--CA 1.435 -1.201 0 CA-C-N 113.073 -1.876 . . . . 0.0 112.412 174.05 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 194' ' ' PRO . . . . . 0.507 ' HD3' ' N ' ' B' ' 193' ' ' CYS . 64.0 Cg_endo -87.24 -25.21 1.09 Allowed 'Trans proline' 0 N--CA 1.459 -0.531 0 C-N-CA 122.596 2.197 . . . . 0.0 112.362 179.671 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -94.69 -173.86 3.13 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.265 -179.611 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 196' ' ' THR . . . . . 0.643 ' N ' ' HD3' ' B' ' 197' ' ' PRO . 0.2 OUTLIER -160.36 48.78 0.26 Allowed Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.634 -179.915 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 197' ' ' PRO . . . . . 0.643 ' HD3' ' N ' ' B' ' 196' ' ' THR . 6.0 Cg_exo -74.93 16.75 0.63 Allowed 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 121.879 1.719 . . . . 0.0 108.768 176.182 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 198' ' ' TYR . . . . . 0.58 ' H ' ' C ' ' B' ' 196' ' ' THR . 11.9 t80 . . . . . 0 C--O 1.25 1.08 0 CA-C-N 113.771 -1.559 . . . . 0.0 111.326 -178.659 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.382 0 CA-C-O 120.816 0.341 . . . . 0.0 111.01 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.637 HG11 HG22 ' A' ' 15' ' ' THR . 60.9 t 63.4 159.19 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.826 -179.653 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.513 ' N ' HG12 ' A' ' 2' ' ' VAL . 38.6 m -96.05 177.4 5.75 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.666 -179.657 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . 0.806 ' CA ' HG21 ' A' ' 14' ' ' VAL . 0.0 OUTLIER -135.62 160.97 36.85 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.652 -0.249 . . . . 0.0 110.594 179.835 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.633 HG21 ' HA ' ' A' ' 11' ' ' ILE . 20.5 p -21.96 134.43 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 113.373 0.879 . . . . 0.0 113.373 -179.753 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.542 ' OG1' HD11 ' A' ' 42' ' ' LEU . 3.7 t -101.02 -15.13 17.56 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.266 178.852 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.729 ' HB1' ' HG3' ' B' ' 194' ' ' PRO . . . -63.85 -161.73 0.01 OUTLIER 'General case' 0 C--O 1.232 0.142 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.905 179.718 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.753 HG23 ' HD3' ' A' ' 10' ' ' PRO . 2.8 t -57.89 -14.67 6.57 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.81 -0.177 . . . . 0.0 111.3 179.787 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.644 ' CB ' ' O ' ' A' ' 8' ' ' THR . 43.9 t 121.36 14.11 0.0 OUTLIER Pre-proline 0 N--CA 1.476 0.857 0 N-CA-C 114.359 1.244 . . . . 0.0 114.359 178.565 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.78 ' CG ' HG23 ' B' ' 196' ' ' THR . 56.2 Cg_endo -77.42 -88.32 0.0 OUTLIER 'Trans proline' 0 C--N 1.358 1.046 0 CA-C-N 121.209 1.467 . . . . 0.0 112.598 179.758 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.633 ' HA ' HG21 ' A' ' 5' ' ' THR . 8.4 tt -158.39 136.72 2.94 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.16 0 CA-C-O 120.981 0.419 . . . . 0.0 111.402 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.623 ' N ' HG22 ' A' ' 5' ' ' THR . 0.9 OUTLIER -153.95 -168.53 2.99 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.041 -179.933 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -119.21 55.77 0.93 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.019 179.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.806 HG21 ' CA ' ' A' ' 4' ' ' HIS . 0.2 OUTLIER -52.61 -100.71 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.343 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.462 -179.78 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.637 HG22 HG11 ' A' ' 2' ' ' VAL . 54.8 p 44.91 91.19 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 120.867 0.365 . . . . 0.0 111.115 -179.999 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.594 ' HB3' ' HD3' ' A' ' 17' ' ' PRO . 14.7 t -120.98 -51.6 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.285 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -179.33 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.594 ' HD3' ' HB3' ' A' ' 16' ' ' CYS . 1.4 Cg_endo -83.47 110.69 1.72 Allowed 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.68 2.253 . . . . 0.0 112.716 -179.196 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -78.0 -63.34 0.03 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.572 0 C-N-CA 122.263 1.976 . . . . 0.0 111.709 179.375 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -134.3 17.01 4.33 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.96 -0.638 . . . . 0.0 112.191 179.32 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.425 ' O ' ' CG ' ' A' ' 21' ' ' ASN . 0.0 OUTLIER 173.17 -165.88 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.702 0.287 . . . . 0.0 110.729 -179.895 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.488 ' HA ' ' HA ' ' A' ' 46' ' ' ALA . 1.4 p30 67.18 3.93 3.42 Favored 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 112.718 0.636 . . . . 0.0 112.718 179.576 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.679 HD22 ' HB2' ' A' ' 61' ' ' SER . 0.8 OUTLIER 39.04 -161.89 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 178.881 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.461 ' H ' ' H ' ' A' ' 61' ' ' SER . 0.1 OUTLIER -121.28 -11.41 8.8 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.008 -179.935 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.556 ' HB2' ' H ' ' A' ' 44' ' ' CYS . 0.9 OUTLIER 46.54 -174.83 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 120.785 0.326 . . . . 0.0 111.229 -179.738 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.461 ' CD ' ' HG3' ' A' ' 67' ' ' PRO . 14.3 ttt-85 172.56 94.77 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.892 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.411 ' CG ' ' N ' ' A' ' 27' ' ' MET . 0.3 OUTLIER -62.11 163.97 7.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.276 179.483 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . 0.411 ' N ' ' CG ' ' A' ' 26' ' ' LYS . 66.0 ttp -153.71 163.27 40.29 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.607 179.685 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' TRP . . . . . 0.824 ' HB2' HG11 ' A' ' 39' ' ' VAL . 0.0 OUTLIER -114.98 -74.15 0.62 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.06 179.963 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 1.5 m 60.32 52.0 5.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.913 0.387 . . . . 0.0 110.715 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.417 ' HB3' ' CE3' ' A' ' 28' ' ' TRP . 3.6 p30 -87.41 157.5 19.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.097 -179.85 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . 57.16 52.44 8.99 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.162 179.712 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER 56.26 97.43 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.795 179.962 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.42 ' O ' ' N ' ' A' ' 35' ' ' SER . 0.3 OUTLIER -56.56 -73.72 0.06 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.058 -179.827 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 16.3 t 55.08 -85.89 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.014 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.42 ' N ' ' O ' ' A' ' 33' ' ' CYS . 56.7 p -101.09 23.82 10.26 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.867 0.365 . . . . 0.0 110.769 179.663 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.411 ' CA ' ' HE3' ' A' ' 70' ' ' LYS . 0.2 OUTLIER -119.7 -163.07 0.96 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.499 179.987 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 122.01 11.38 5.83 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.545 -0.836 . . . . 0.0 112.85 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.86 56.18 2.65 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.037 0.446 . . . . 0.0 110.762 179.797 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.824 HG11 ' HB2' ' A' ' 28' ' ' TRP . 23.8 t -122.24 141.3 43.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.725 179.927 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.625 HG21 ' HB ' ' B' ' 191' ' ' THR . 35.7 m -141.83 -178.5 1.36 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 120.927 0.394 . . . . 0.0 111.461 -179.871 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 171.93 -28.81 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.057 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.542 HD11 ' OG1' ' A' ' 6' ' ' THR . 41.8 mt 69.73 158.2 0.17 Allowed 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.808 -179.763 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.457 ' HA3' ' CB ' ' A' ' 24' ' ' TYR . . . -139.64 -65.97 0.04 OUTLIER Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.364 -0.922 . . . . 0.0 113.184 -179.739 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.556 ' H ' ' HB2' ' A' ' 24' ' ' TYR . 24.3 t 51.86 86.94 0.03 OUTLIER 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 117.081 0.44 . . . . 0.0 110.166 -179.539 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.424 ' O ' ' HA ' ' A' ' 21' ' ' ASN . . . -153.56 155.91 37.04 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.966 0.412 . . . . 0.0 111.989 -178.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.488 ' HA ' ' HA ' ' A' ' 21' ' ' ASN . . . -85.66 80.13 9.11 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.436 179.941 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.45 ' OG1' ' N ' ' A' ' 48' ' ' CYS . 0.6 OUTLIER -170.58 -179.61 2.99 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.649 179.831 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.676 ' O ' ' N ' ' A' ' 50' ' ' SER . 0.5 OUTLIER 179.02 -48.24 0.0 OUTLIER Pre-proline 0 C--N 1.333 -0.148 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.568 179.934 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.426 ' CD ' ' N ' ' A' ' 48' ' ' CYS . 53.8 Cg_exo -52.28 72.56 0.02 OUTLIER 'Trans proline' 0 C--N 1.351 0.694 0 C-N-CA 122.083 1.855 . . . . 0.0 111.067 179.685 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.676 ' N ' ' O ' ' A' ' 48' ' ' CYS . 28.7 t -118.63 -80.01 0.61 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.378 -0.828 . . . . 0.0 111.258 -178.342 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 10.2 mtmm 58.91 34.21 23.51 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.836 0.351 . . . . 0.0 111.043 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.41 162.44 33.69 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.809 179.925 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -60.32 -67.84 0.05 OUTLIER 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.494 2.129 . . . . 0.0 112.117 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -74.34 -13.25 60.72 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.134 179.937 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 63.17 -80.14 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.941 -179.913 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.476 ' O ' HG23 ' A' ' 57' ' ' VAL . 17.1 tt0 58.81 23.97 11.84 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.986 179.924 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.494 HG12 ' CD1' ' A' ' 24' ' ' TYR . 71.0 t -159.4 -76.6 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.625 -179.881 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 60.15 118.39 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.35 179.785 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . 0.489 ' HA ' ' CD1' ' A' ' 24' ' ' TYR . 1.2 m -50.97 138.76 18.67 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.939 179.67 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.611 ' SG ' ' N ' ' A' ' 65' ' ' CYS . 48.5 t -112.07 -83.91 0.58 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.708 -179.593 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.679 ' HB2' HD22 ' A' ' 22' ' ' LEU . 47.0 t 65.65 -148.32 0.22 Allowed 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.138 -179.32 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.528 HG23 ' O ' ' A' ' 61' ' ' SER . 0.2 OUTLIER 49.09 -86.82 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 122.147 0.179 . . . . 0.0 111.22 -179.806 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . 0.491 ' O ' ' NE2' ' A' ' 4' ' ' HIS . 1.6 p30 -153.64 79.03 1.15 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.666 0.269 . . . . 0.0 111.659 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.5 ' HB2' ' HB3' ' A' ' 3' ' ' CYS . 0.0 OUTLIER 41.19 23.61 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.788 0.662 . . . . 0.0 112.788 179.365 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . 0.611 ' N ' ' SG ' ' A' ' 60' ' ' CYS . 0.5 OUTLIER 69.82 -42.39 0.51 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.722 0.296 . . . . 0.0 111.016 179.998 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.617 ' N ' ' HD3' ' A' ' 67' ' ' PRO . 0.9 OUTLIER 57.37 53.33 6.29 Favored Pre-proline 0 C--O 1.232 0.179 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.677 -179.659 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . 0.617 ' HD3' ' N ' ' A' ' 66' ' ' ASN . 19.5 Cg_endo -92.29 -66.36 0.01 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.945 0 C-N-CA 123.075 2.517 . . . . 0.0 111.521 179.148 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.592 ' HB3' ' HD2' ' A' ' 69' ' ' PRO . 82.5 m-70 58.21 166.24 0.07 OUTLIER Pre-proline 0 C--N 1.331 -0.197 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.087 179.148 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.592 ' HD2' ' HB3' ' A' ' 68' ' ' HIS . 28.2 Cg_exo -35.15 123.72 0.21 Allowed 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 123.1 2.533 . . . . 0.0 113.145 -179.798 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.413 ' HD3' ' N ' ' A' ' 71' ' ' GLN . 0.0 OUTLIER -98.08 -7.18 30.2 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.236 -179.964 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.413 ' N ' ' HD3' ' A' ' 70' ' ' LYS . 2.1 tt0 -76.49 -16.84 59.56 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.424 179.937 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.514 ' HB2' ' HD3' ' A' ' 73' ' ' PRO . 3.9 mmp_? -66.09 -56.06 18.5 Favored Pre-proline 0 CA--C 1.531 0.238 0 CA-C-N 116.618 -0.265 . . . . 0.0 111.618 -179.592 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.514 ' HD3' ' HB2' ' A' ' 72' ' ' ARG . 36.1 Cg_endo -64.53 -46.26 7.56 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 122.182 1.922 . . . . 0.0 112.264 -179.96 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.444 -1.198 . . . . 0.0 112.499 179.995 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 181' ' ' TYR . . . . . . . . . . . . . 5.0 t80 . . . . . 0 N--CA 1.487 1.377 0 CA-C-O 120.771 0.319 . . . . 0.0 111.102 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 182' ' ' ARG . . . . . . . . . . . . . 28.3 ttp85 -149.56 99.74 2.92 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.9 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 183' ' ' GLY . . . . . . . . . . . . . . . -157.03 47.45 0.47 Allowed Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.458 -179.958 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 184' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -128.24 135.58 49.87 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.847 0.356 . . . . 0.0 110.878 179.925 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 185' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -87.62 -168.26 2.16 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.843 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 186' ' ' HIS . . . . . . . . . . . . . 50.5 t-80 -88.2 -80.79 0.27 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.773 179.876 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 187' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -88.86 166.96 13.63 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 120.827 0.346 . . . . 0.0 110.86 179.807 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 188' ' ' VAL . . . . . 0.401 HG23 ' H ' ' B' ' 188' ' ' VAL . 0.2 OUTLIER -79.88 -71.99 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.434 -179.594 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 189' ' ' TYR . . . . . . . . . . . . . 9.7 m-85 -107.94 153.77 22.57 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.519 -0.31 . . . . 0.0 111.151 -179.638 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 190' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -160.15 104.8 1.5 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 121.169 0.509 . . . . 0.0 111.422 179.738 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 191' ' ' THR . . . . . 0.625 ' HB ' HG21 ' A' ' 40' ' ' VAL . 1.3 t -91.08 43.5 1.15 Allowed 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.925 179.314 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 192' ' ' CYS . . . . . 0.706 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.5 OUTLIER -90.21 -56.86 3.05 Favored 'General case' 0 CA--C 1.497 -1.077 0 CA-C-O 121.798 0.809 . . . . 0.0 112.007 -179.401 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 193' ' ' CYS . . . . . 0.706 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.0 OUTLIER -153.98 103.17 2.46 Favored Pre-proline 0 N--CA 1.436 -1.15 0 CA-C-N 113.734 -1.576 . . . . 0.0 111.964 -173.444 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 194' ' ' PRO . . . . . 0.729 ' HG3' ' HB1' ' A' ' 7' ' ' ALA . 38.3 Cg_endo -81.74 -66.7 0.02 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.768 0 C-N-CA 122.395 2.063 . . . . 0.0 111.979 179.486 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -172.63 14.88 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 113.294 0.85 . . . . 0.0 113.294 179.819 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 196' ' ' THR . . . . . 0.78 HG23 ' CG ' ' A' ' 10' ' ' PRO . 1.4 t -147.2 36.85 0.17 Allowed Pre-proline 0 C--N 1.334 -0.094 0 C-N-CA 120.389 -0.524 . . . . 0.0 112.024 179.725 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 197' ' ' PRO . . . . . 0.595 ' HB3' HG21 ' A' ' 8' ' ' THR . 72.1 Cg_endo -72.2 13.7 0.51 Allowed 'Trans proline' 0 C--N 1.35 0.612 0 C-N-CA 121.518 1.478 . . . . 0.0 109.359 176.113 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 198' ' ' TYR . . . . . 0.591 ' H ' ' C ' ' B' ' 196' ' ' THR . 1.1 t80 . . . . . 0 C--O 1.248 0.976 0 CA-C-N 114.12 -1.4 . . . . 0.0 111.289 -178.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . 0.733 HD13 HG12 ' A' ' 2' ' ' VAL . 0.1 OUTLIER . . . . . 0 N--CA 1.485 1.309 0 CA-C-O 120.466 0.174 . . . . 0.0 110.812 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.733 HG12 HD13 ' A' ' 1' ' ' ILE . 4.0 p 147.44 138.08 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 C-N-CA 123.461 0.705 . . . . 0.0 110.439 179.388 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.487 ' O ' ' C ' ' A' ' 4' ' ' HIS . 0.5 OUTLIER -160.08 54.01 0.34 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.68 -179.719 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . 0.545 ' N ' HG23 ' A' ' 14' ' ' VAL . 4.9 p-80 -23.7 110.31 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 122.659 0.384 . . . . 0.0 112.033 179.627 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.411 ' CG2' ' N ' ' A' ' 13' ' ' ALA . 2.6 t -44.82 149.86 0.4 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.07 -0.513 . . . . 0.0 111.319 -179.642 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.757 HG22 ' HB3' ' A' ' 66' ' ' ASN . 16.8 p -81.01 2.34 27.41 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.448 -179.935 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.507 ' C ' HG23 ' A' ' 8' ' ' THR . . . -58.19 88.69 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.727 0.299 . . . . 0.0 111.205 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.816 HG22 ' O ' ' B' ' 192' ' ' CYS . 1.2 p 71.1 173.7 0.31 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.049 0.452 . . . . 0.0 111.206 179.55 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.503 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 6.0 t -58.8 -58.91 15.79 Favored Pre-proline 0 C--N 1.33 -0.283 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.752 -179.695 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.8 ' O ' HG23 ' A' ' 11' ' ' ILE . 9.5 Cg_endo -52.01 -93.27 0.0 OUTLIER 'Trans proline' 0 CA--C 1.534 0.495 0 C-N-CA 122.505 2.137 . . . . 0.0 112.652 -179.168 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.8 HG23 ' O ' ' A' ' 10' ' ' PRO . 0.2 OUTLIER 170.9 176.66 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.277 0 CA-C-O 120.664 0.269 . . . . 0.0 110.742 -179.797 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.578 ' O ' ' HB2' ' A' ' 13' ' ' ALA . 0.4 OUTLIER -177.09 17.24 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 179.669 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.578 ' HB2' ' O ' ' A' ' 12' ' ' SER . . . 168.54 66.03 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.756 0.312 . . . . 0.0 111.741 179.814 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.607 ' C ' HG23 ' A' ' 15' ' ' THR . 6.9 p -89.95 165.11 2.05 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.584 179.627 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.692 ' HA ' ' HA ' ' A' ' 2' ' ' VAL . 2.1 p 85.57 106.68 0.05 OUTLIER 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 122.962 0.505 . . . . 0.0 110.961 -179.684 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.471 ' N ' ' HD3' ' A' ' 17' ' ' PRO . 46.5 t -133.83 59.45 39.17 Favored Pre-proline 0 CA--C 1.533 0.294 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.721 -179.905 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.535 ' CB ' ' HD3' ' A' ' 18' ' ' PRO . 10.5 Cg_exo -66.79 -55.49 0.33 Allowed 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 122.058 1.839 . . . . 0.0 112.98 179.996 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.535 ' HD3' ' CB ' ' A' ' 17' ' ' PRO . 43.4 Cg_endo -97.16 -166.5 0.1 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.77 0 C-N-CA 122.818 2.345 . . . . 0.0 112.795 -179.4 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 78.33 -65.4 3.37 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.801 179.48 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -113.32 156.42 23.4 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.978 0.418 . . . . 0.0 111.207 -179.577 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.724 ' O ' HD13 ' A' ' 22' ' ' LEU . 0.2 OUTLIER -103.3 40.21 1.44 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.62 179.871 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.724 HD13 ' O ' ' A' ' 21' ' ' ASN . 0.6 OUTLIER 165.82 -172.99 0.02 OUTLIER 'General case' 0 N--CA 1.461 0.121 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.033 -179.692 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.575 ' HB2' ' C ' ' A' ' 60' ' ' CYS . 1.6 m -120.32 88.55 2.96 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.429 0.633 . . . . 0.0 111.292 -179.835 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.655 ' HD2' HD22 ' A' ' 42' ' ' LEU . 14.7 t80 -78.51 125.38 29.29 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.063 -0.971 . . . . 0.0 112.201 -179.254 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.659 ' NH1' HG22 ' A' ' 58' ' ' THR . 0.0 OUTLIER -155.97 137.72 14.29 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.651 -0.25 . . . . 0.0 110.653 179.263 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.644 ' HG2' HG12 ' A' ' 57' ' ' VAL . 4.5 mttt -80.04 145.25 32.58 Favored 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 120.901 -0.32 . . . . 0.0 110.922 -179.831 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . 0.457 ' HE1' ' HG2' ' A' ' 67' ' ' PRO . 50.1 tpp -153.49 146.05 24.14 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.332 -179.783 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' TRP . . . . . 0.564 ' HB3' HG21 ' A' ' 39' ' ' VAL . 0.3 OUTLIER -149.04 -160.54 1.19 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.768 179.88 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . 0.641 ' HA ' ' HB3' ' A' ' 33' ' ' CYS . 0.1 OUTLIER 85.68 -17.6 0.4 Allowed 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 122.806 0.442 . . . . 0.0 111.724 -179.921 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.41 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 41.1 m-20 -54.19 126.73 24.05 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.776 0.322 . . . . 0.0 110.978 -179.91 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.41 ' HB3' ' O ' ' A' ' 30' ' ' ASP . . . 67.28 -72.29 0.09 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.878 -179.793 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.452 ' O ' ' SG ' ' A' ' 33' ' ' CYS . 18.6 m-85 -71.63 -164.24 0.12 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.34 179.647 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.641 ' HB3' ' HA ' ' A' ' 29' ' ' CYS . 0.5 OUTLIER 74.51 -50.12 0.67 Allowed 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 112.094 0.405 . . . . 0.0 112.094 179.554 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.402 ' N ' ' SG ' ' A' ' 33' ' ' CYS . 0.3 OUTLIER 53.73 55.6 8.28 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.871 0.367 . . . . 0.0 110.685 -179.854 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 67.28 35.2 4.5 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.14 -179.811 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -144.71 12.8 1.49 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.866 -179.909 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.432 ' N ' ' HB2' ' A' ' 33' ' ' CYS . . . -87.7 -52.39 3.0 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.647 -0.787 . . . . 0.0 112.862 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.522 ' HG3' ' HB3' ' B' ' 190' ' ' TYR . 0.0 OUTLIER 36.47 74.91 0.07 Allowed 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 120.839 0.352 . . . . 0.0 111.111 -179.677 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.564 HG21 ' HB3' ' A' ' 28' ' ' TRP . 18.9 t -118.64 124.81 73.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 121.174 0.511 . . . . 0.0 111.917 -179.082 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 27.1 m -158.3 159.37 2.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.838 179.31 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.423 ' CG ' ' HB2' ' A' ' 26' ' ' LYS . 0.1 OUTLIER 175.52 -87.15 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.936 0.717 . . . . 0.0 112.936 -179.656 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.655 HD22 ' HD2' ' A' ' 24' ' ' TYR . 0.3 OUTLIER -51.77 -175.75 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.14 0 N-CA-C 112.88 0.696 . . . . 0.0 112.88 -177.761 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 166.59 93.84 0.09 OUTLIER Glycine 0 N--CA 1.448 -0.554 0 N-CA-C 110.165 -1.174 . . . . 0.0 110.165 -179.209 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.507 ' N ' ' O ' ' A' ' 24' ' ' TYR . 0.1 OUTLIER 76.57 109.29 0.08 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.041 0.448 . . . . 0.0 110.49 -178.155 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.551 ' O ' ' N ' ' A' ' 47' ' ' THR . . . -173.5 147.11 1.42 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.137 -179.668 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.512 ' C ' HG22 ' A' ' 47' ' ' THR . . . 47.33 -82.43 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.709 179.394 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.551 ' N ' ' O ' ' A' ' 45' ' ' ALA . 1.2 t 156.76 62.19 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.402 179.821 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.537 ' CB ' HD23 ' A' ' 22' ' ' LEU . 49.6 t 43.91 53.51 10.41 Favored Pre-proline 0 N--CA 1.466 0.375 0 N-CA-C 111.787 0.292 . . . . 0.0 111.787 179.688 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.515 ' HD3' ' N ' ' A' ' 48' ' ' CYS . 37.4 Cg_exo -55.0 -25.45 44.6 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 121.984 1.789 . . . . 0.0 111.002 179.088 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.402 ' HB2' ' CG2' ' A' ' 57' ' ' VAL . 3.0 t -55.78 179.95 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.206 -0.906 . . . . 0.0 111.323 179.751 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 11.8 ptpt 175.89 -47.72 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.035 179.881 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.436 ' HB2' ' CE2' ' A' ' 54' ' ' TYR . 0.0 OUTLIER -75.02 149.27 85.08 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.974 -179.898 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -59.32 -47.66 16.34 Favored 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.59 2.194 . . . . 0.0 112.364 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . 0.436 ' CE2' ' HB2' ' A' ' 52' ' ' LYS . 0.0 OUTLIER -64.49 75.91 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.996 -179.751 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -152.27 -160.36 1.13 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.161 -179.877 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.482 ' O ' ' HA ' ' A' ' 26' ' ' LYS . 17.9 tt0 -148.87 21.28 1.0 Allowed 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 120.525 0.202 . . . . 0.0 110.604 179.452 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.644 HG12 ' HG2' ' A' ' 26' ' ' LYS . 4.8 m -145.61 -174.12 0.47 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.106 0 CA-C-O 120.891 0.376 . . . . 0.0 110.989 179.63 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.659 HG22 ' NH1' ' A' ' 25' ' ' ARG . 8.9 t 178.39 -170.28 0.1 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.425 179.569 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -101.29 134.78 43.82 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.872 0.367 . . . . 0.0 110.292 179.681 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.575 ' C ' ' HB2' ' A' ' 23' ' ' CYS . 0.5 OUTLIER -123.45 15.68 9.65 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.448 -179.418 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.584 ' O ' HG23 ' A' ' 62' ' ' THR . 0.3 OUTLIER -64.94 95.16 0.15 Allowed 'General case' 0 C--N 1.333 -0.116 0 CA-C-O 121.057 0.456 . . . . 0.0 111.289 -179.123 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.584 HG23 ' O ' ' A' ' 61' ' ' SER . 0.1 OUTLIER 168.39 67.81 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.377 179.826 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . 0.621 ' HA ' HG13 ' A' ' 2' ' ' VAL . 1.2 t0 64.81 -163.91 0.25 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.551 -179.737 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.416 ' HB3' ' CE1' ' A' ' 4' ' ' HIS . 0.0 OUTLIER -60.74 87.59 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.88 0.371 . . . . 0.0 110.306 179.864 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 16.7 t -94.95 -50.01 5.3 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.941 -179.735 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.757 ' HB3' HG22 ' A' ' 6' ' ' THR . 29.4 m-20 -43.29 100.47 0.23 Allowed Pre-proline 0 N--CA 1.463 0.201 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.533 -179.761 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . 0.457 ' HG2' ' HE1' ' A' ' 27' ' ' MET . 95.6 Cg_endo -90.89 131.57 1.53 Allowed 'Trans proline' 0 N--CA 1.454 -0.797 0 C-N-CA 122.732 2.288 . . . . 0.0 112.059 -180.0 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 5.7 p80 -48.0 161.49 0.36 Allowed Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.726 179.83 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.552 ' HG2' ' HB ' ' B' ' 191' ' ' THR . 75.3 Cg_exo -47.21 173.07 0.03 OUTLIER 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.429 2.086 . . . . 0.0 112.083 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.436 ' O ' ' C ' ' A' ' 71' ' ' GLN . 0.0 OUTLIER -54.47 -27.35 36.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.034 -179.817 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.436 ' C ' ' O ' ' A' ' 70' ' ' LYS . 22.8 tp60 25.42 -91.15 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.487 0 O-C-N 123.571 0.544 . . . . 0.0 112.388 179.78 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.489 ' HB2' ' HD3' ' A' ' 73' ' ' PRO . 0.0 OUTLIER -96.2 -53.13 0.22 Allowed Pre-proline 0 CA--C 1.528 0.128 0 CA-C-O 120.47 0.176 . . . . 0.0 110.762 179.767 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.489 ' HD3' ' HB2' ' A' ' 72' ' ' ARG . 15.5 Cg_exo -68.67 113.32 3.14 Favored 'Trans proline' 0 C--N 1.349 0.559 0 C-N-CA 122.42 2.08 . . . . 0.0 112.162 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.088 0 CA-C-O 118.313 -1.27 . . . . 0.0 112.521 -179.937 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 181' ' ' TYR . . . . . . . . . . . . . 9.5 p90 . . . . . 0 N--CA 1.486 1.351 0 CA-C-O 120.562 0.22 . . . . 0.0 111.059 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 182' ' ' ARG . . . . . . . . . . . . . 1.6 mtp85 68.61 30.95 4.89 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.891 0.376 . . . . 0.0 110.656 -179.835 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 183' ' ' GLY . . . . . . . . . . . . . . . -150.84 53.53 0.49 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.896 -0.668 . . . . 0.0 112.3 179.883 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 184' ' ' TRP . . . . . . . . . . . . . 16.4 m95 -91.7 12.68 20.42 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.75 0.31 . . . . 0.0 111.465 -179.809 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 185' ' ' LYS . . . . . . . . . . . . . 38.4 tttt -49.68 128.65 18.31 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.931 0.396 . . . . 0.0 111.215 -179.825 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 186' ' ' HIS . . . . . . . . . . . . . 9.5 t-160 -119.7 78.92 1.37 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.77 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 187' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -84.76 -172.5 4.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.044 -179.884 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 188' ' ' VAL . . . . . 0.432 HG21 ' HE2' ' A' ' 38' ' ' LYS . 0.1 OUTLIER -90.83 -169.93 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.24 -179.654 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 189' ' ' TYR . . . . . 0.405 ' CE1' ' OE1' ' A' ' 41' ' ' GLU . 0.7 OUTLIER -119.98 58.7 0.9 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.013 -179.729 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 190' ' ' TYR . . . . . 0.522 ' HB3' ' HG3' ' A' ' 38' ' ' LYS . 2.4 p90 -79.74 174.0 12.03 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.045 -179.832 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 191' ' ' THR . . . . . 0.552 ' HB ' ' HG2' ' A' ' 69' ' ' PRO . 0.6 OUTLIER -42.88 142.11 0.97 Allowed 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.292 179.729 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 192' ' ' CYS . . . . . 0.816 ' O ' HG22 ' A' ' 8' ' ' THR . 0.0 OUTLIER -90.13 168.66 11.8 Favored 'General case' 0 CA--C 1.498 -1.036 0 CA-C-O 121.959 0.885 . . . . 0.0 111.467 179.687 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 193' ' ' CYS . . . . . 0.704 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.1 OUTLIER 44.67 178.26 0.0 OUTLIER Pre-proline 0 C--N 1.314 -0.972 0 CA-C-N 113.048 -1.887 . . . . 0.0 112.954 173.622 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 194' ' ' PRO . . . . . 0.599 ' O ' HG21 ' A' ' 8' ' ' THR . 95.2 Cg_endo -86.75 -178.62 2.68 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.815 2.343 . . . . 0.0 112.706 -179.469 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -116.09 -69.48 0.85 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.296 -179.858 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 196' ' ' THR . . . . . 0.601 ' C ' ' H ' ' B' ' 198' ' ' TYR . 12.8 t -143.05 40.79 0.34 Allowed Pre-proline 0 C--N 1.33 -0.256 0 N-CA-C 112.376 0.509 . . . . 0.0 112.376 -179.449 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 197' ' ' PRO . . . . . 0.526 ' CD ' ' N ' ' B' ' 196' ' ' THR . 73.8 Cg_endo -74.38 17.79 0.51 Allowed 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 121.52 1.48 . . . . 0.0 108.987 175.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 198' ' ' TYR . . . . . 0.601 ' H ' ' C ' ' B' ' 196' ' ' THR . 77.9 t80 . . . . . 0 C--O 1.249 1.079 0 CA-C-N 113.994 -1.457 . . . . 0.0 111.272 -178.915 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . 0.749 HG23 ' HA ' ' A' ' 62' ' ' THR . 27.2 mm . . . . . 0 N--CA 1.487 1.375 0 CA-C-O 120.899 0.38 . . . . 0.0 111.09 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.652 HG22 ' HA ' ' A' ' 15' ' ' THR . 1.1 p -174.98 178.81 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.033 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.612 ' H ' HG22 ' A' ' 2' ' ' VAL . 0.1 OUTLIER -127.0 92.23 3.49 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 120.636 0.255 . . . . 0.0 111.656 -179.527 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . 0.585 ' HA ' HG11 ' A' ' 14' ' ' VAL . 75.0 m80 -39.58 147.22 0.08 Allowed 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.902 179.816 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 1.0 HG23 HG12 ' A' ' 14' ' ' VAL . 18.9 p -71.9 79.89 0.9 Allowed 'General case' 0 C--N 1.334 -0.085 0 CA-C-O 120.902 0.382 . . . . 0.0 111.411 -179.467 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.576 ' HA ' HD23 ' A' ' 42' ' ' LEU . 4.7 p 63.31 7.48 2.91 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.734 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.513 ' HB3' ' O ' ' A' ' 6' ' ' THR . . . 73.83 -55.62 0.66 Allowed 'General case' 0 N--CA 1.462 0.174 0 N-CA-C 111.909 0.336 . . . . 0.0 111.909 179.506 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.663 HG22 ' HA ' ' B' ' 191' ' ' THR . 33.9 p -30.03 130.19 0.09 Allowed 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 -179.539 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.456 ' HB3' ' HD2' ' A' ' 10' ' ' PRO . 0.5 OUTLIER 68.22 167.25 0.12 Allowed Pre-proline 0 C--N 1.331 -0.22 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.519 -179.771 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.456 ' HD2' ' HB3' ' A' ' 9' ' ' SER . 28.0 Cg_endo -60.57 -34.03 92.95 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.581 2.187 . . . . 0.0 111.795 179.759 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.429 HG12 ' O ' ' A' ' 10' ' ' PRO . 0.1 OUTLIER 47.86 -160.63 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.85 179.598 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.614 ' O ' HG13 ' A' ' 14' ' ' VAL . 1.5 p 170.11 -64.4 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 120.833 0.349 . . . . 0.0 110.591 -179.568 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.3 81.79 0.09 Allowed 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 179.234 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 1.0 HG12 HG23 ' A' ' 5' ' ' THR . 0.8 OUTLIER -127.7 151.32 34.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.289 -178.669 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.652 ' HA ' HG22 ' A' ' 2' ' ' VAL . 0.1 OUTLIER 160.4 82.01 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.158 179.317 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.554 ' HB2' ' HD2' ' A' ' 17' ' ' PRO . 0.8 OUTLIER -63.03 179.31 0.31 Allowed Pre-proline 0 CA--C 1.532 0.264 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 179.113 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.554 ' HD2' ' HB2' ' A' ' 16' ' ' CYS . 28.8 Cg_exo -33.81 114.25 0.08 OUTLIER 'Trans proline' 0 C--N 1.35 0.617 0 C-N-CA 122.662 2.241 . . . . 0.0 113.144 -179.208 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_exo -46.09 177.79 0.01 OUTLIER 'Trans proline' 0 C--N 1.35 0.608 0 C-N-CA 123.196 2.598 . . . . 0.0 113.33 -179.168 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 69.39 -158.72 53.23 Favored Glycine 0 N--CA 1.451 -0.345 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.981 -179.729 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -57.96 -166.18 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 110.209 -0.293 . . . . 0.0 110.209 179.424 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.576 ' CB ' ' HB2' ' A' ' 46' ' ' ALA . 0.0 OUTLIER 66.23 90.38 0.09 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.186 0.517 . . . . 0.0 109.724 -179.899 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.553 ' HB3' ' HB3' ' A' ' 60' ' ' CYS . 0.7 OUTLIER -112.52 178.12 4.4 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.315 0.578 . . . . 0.0 112.13 -178.9 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.574 ' O ' ' HB2' ' A' ' 60' ' ' CYS . 12.7 m -62.62 84.94 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.264 -0.88 . . . . 0.0 112.877 -178.278 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.531 ' HB3' ' HA ' ' A' ' 59' ' ' CYS . 40.0 p90 -68.09 70.24 0.15 Allowed 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.507 0.67 . . . . 0.0 109.298 178.153 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.463 ' N ' ' O ' ' A' ' 23' ' ' CYS . 0.0 OUTLIER -41.15 147.1 0.15 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.11 -0.95 . . . . 0.0 112.948 -178.347 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.496 ' CG ' HG13 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -130.48 171.89 12.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 114.974 -1.012 . . . . 0.0 109.547 179.065 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 2.3 ttp -160.53 -176.55 5.64 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.916 0.389 . . . . 0.0 111.574 -179.776 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' TRP . . . . . 0.492 ' HB2' ' CG2' ' A' ' 39' ' ' VAL . 0.4 OUTLIER -100.3 -164.35 1.11 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.246 -179.948 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER 69.7 -65.37 0.31 Allowed 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.809 -179.935 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 61.97 78.51 0.29 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.25 179.659 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . 48.89 45.01 22.53 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.447 179.631 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -152.23 -170.56 3.68 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.688 179.862 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 44.89 -170.76 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.448 179.822 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 47.7 t -89.58 -28.56 19.48 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.472 179.636 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.461 ' O ' ' N ' ' A' ' 37' ' ' GLY . 1.3 p -179.74 -49.58 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.796 179.814 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 30.87 -87.22 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.329 0.652 . . . . 0.0 112.496 179.614 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.461 ' N ' ' O ' ' A' ' 35' ' ' SER . . . 62.05 -105.76 1.03 Allowed Glycine 0 C--N 1.332 0.347 0 C-N-CA 120.508 -0.853 . . . . 0.0 112.781 179.795 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.487 ' HA ' ' HD2' ' A' ' 38' ' ' LYS . 0.4 OUTLIER 45.26 43.6 8.26 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 121.174 0.511 . . . . 0.0 111.745 179.944 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.492 ' CG2' ' HB2' ' A' ' 28' ' ' TRP . 3.3 t -137.68 105.46 3.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.136 178.656 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.963 HG11 ' HB ' ' B' ' 191' ' ' THR . 12.1 p -110.83 163.4 7.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-O 121.231 0.538 . . . . 0.0 112.354 -178.198 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.531 ' N ' HG22 ' A' ' 40' ' ' VAL . 0.3 OUTLIER -164.66 -123.71 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.408 -179.975 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.59 HD12 ' N ' ' A' ' 43' ' ' GLY . 1.0 OUTLIER -169.79 -57.24 0.02 OUTLIER 'General case' 0 C--O 1.233 0.188 0 CA-C-N 118.101 0.41 . . . . 0.0 110.976 179.314 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.59 ' N ' HD12 ' A' ' 42' ' ' LEU . . . 96.35 -109.66 3.89 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.746 -0.74 . . . . 0.0 113.108 179.673 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.493 ' HA ' ' O ' ' A' ' 22' ' ' LEU . 52.5 t 74.72 88.01 0.09 Allowed 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.998 0.427 . . . . 0.0 110.503 -178.94 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.408 ' CB ' ' CE1' ' A' ' 24' ' ' TYR . . . -164.68 146.37 8.18 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.729 -0.668 . . . . 0.0 111.12 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.576 ' HB2' ' CB ' ' A' ' 21' ' ' ASN . . . -121.64 76.99 1.31 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.089 -179.796 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.797 HG23 ' HD3' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -172.49 -38.82 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.008 -179.888 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.414 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 5.7 m 59.41 52.32 3.78 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.396 179.532 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.797 ' HD3' HG23 ' A' ' 47' ' ' THR . 59.6 Cg_endo -71.97 -9.82 25.22 Favored 'Trans proline' 0 C--N 1.343 0.266 0 C-N-CA 122.315 2.01 . . . . 0.0 111.578 179.004 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 6.8 t -55.51 140.45 40.46 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.143 179.797 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -168.26 33.66 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.678 179.899 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.419 ' HB3' ' HD2' ' A' ' 53' ' ' PRO . 1.4 mttm -81.98 158.48 67.39 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.668 -179.887 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . 0.419 ' HD2' ' HB3' ' A' ' 52' ' ' LYS . 12.7 Cg_endo -56.35 -70.48 0.04 OUTLIER 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.527 2.151 . . . . 0.0 112.13 179.93 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . 0.406 ' CZ ' ' HG2' ' A' ' 53' ' ' PRO . 0.0 OUTLIER -70.76 -80.55 0.05 Allowed 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.132 -179.906 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 42.24 -155.26 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.575 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.5 tp10 -175.05 -38.26 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.347 0 CA-C-O 120.687 0.279 . . . . 0.0 111.297 -179.341 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.496 HG13 ' CG ' ' A' ' 26' ' ' LYS . 29.5 m -49.36 149.92 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.993 0.425 . . . . 0.0 111.785 -179.545 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 3.8 t -147.55 20.42 1.18 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.876 179.651 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . 0.531 ' HA ' ' HB3' ' A' ' 24' ' ' TYR . 1.3 m 62.1 124.09 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.975 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.574 ' HB2' ' O ' ' A' ' 23' ' ' CYS . 4.6 t -84.91 -52.65 5.85 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.103 -179.679 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 53.09 99.62 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.314 179.646 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.749 ' HA ' HG23 ' A' ' 1' ' ' ILE . 46.7 p 40.69 96.66 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.902 179.689 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . 0.44 ' O ' ' CG ' ' A' ' 64' ' ' LYS . 1.0 OUTLIER 178.26 -13.14 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 179.634 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.473 ' O ' ' C ' ' A' ' 65' ' ' CYS . 3.8 ptmm? 46.65 31.75 1.48 Allowed 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 120.742 0.306 . . . . 0.0 110.839 -179.405 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . 0.473 ' C ' ' O ' ' A' ' 64' ' ' LYS . 0.1 OUTLIER -17.0 -65.36 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 115.459 -0.791 . . . . 0.0 112.674 -179.757 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.489 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 4.8 t-20 76.5 92.21 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.307 -179.848 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . 0.652 ' HB2' HG23 ' A' ' 40' ' ' VAL . 12.8 Cg_exo -69.4 -171.62 0.46 Allowed 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.759 2.306 . . . . 0.0 112.109 179.83 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 7.4 p80 176.71 158.57 0.46 Allowed Pre-proline 0 C--N 1.331 -0.224 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.839 179.805 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.489 ' HG3' HG23 ' B' ' 191' ' ' THR . 45.1 Cg_exo -55.57 136.35 73.63 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.509 2.139 . . . . 0.0 112.139 179.908 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.424 ' HG2' ' O ' ' A' ' 35' ' ' SER . 0.4 OUTLIER -92.79 -50.62 5.48 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.44 179.812 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.419 ' CB ' ' HG2' ' A' ' 38' ' ' LYS . 42.4 tp60 -77.81 55.5 1.39 Allowed 'General case' 0 C--O 1.232 0.175 0 CA-C-O 120.846 0.355 . . . . 0.0 111.004 179.763 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.603 ' N ' ' CD ' ' A' ' 73' ' ' PRO . 1.3 ptp180 -93.89 -30.33 0.29 Allowed Pre-proline 0 CA--C 1.536 0.438 0 N-CA-C 112.551 0.575 . . . . 0.0 112.551 -179.682 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.603 ' CD ' ' N ' ' A' ' 72' ' ' ARG . 89.3 Cg_endo -83.57 99.52 0.84 Allowed 'Trans proline' 0 C--N 1.35 0.636 0 C-N-CA 121.961 1.774 . . . . 0.0 112.41 -179.738 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.367 -1.241 . . . . 0.0 112.5 -179.995 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 181' ' ' TYR . . . . . 0.441 ' O ' ' HB3' ' B' ' 182' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.584 0 N-CA-C 111.367 0.136 . . . . 0.0 111.367 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 182' ' ' ARG . . . . . 0.441 ' HB3' ' O ' ' B' ' 181' ' ' TYR . 14.7 tpt180 69.58 -65.35 0.31 Allowed 'General case' 0 C--O 1.232 0.158 0 CA-C-O 120.688 0.28 . . . . 0.0 110.816 -179.729 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 183' ' ' GLY . . . . . . . . . . . . . . . -64.43 145.09 49.29 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.34 179.88 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 184' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -118.24 -39.31 3.06 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.758 0.313 . . . . 0.0 110.971 -179.834 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 185' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -120.59 158.02 28.26 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.072 -179.859 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 186' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -146.43 -164.39 1.96 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.649 179.892 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 187' ' ' TRP . . . . . . . . . . . . . 34.4 m95 -75.69 159.11 31.48 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.922 0.391 . . . . 0.0 111.0 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 188' ' ' VAL . . . . . 0.632 HG22 ' N ' ' B' ' 189' ' ' TYR . 0.2 OUTLIER -80.3 -81.32 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.68 179.913 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 189' ' ' TYR . . . . . 0.632 ' N ' HG22 ' B' ' 188' ' ' VAL . 1.7 m-85 -130.06 126.96 38.9 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.782 0.325 . . . . 0.0 110.367 179.675 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 190' ' ' TYR . . . . . 0.454 ' CZ ' ' HE3' ' A' ' 38' ' ' LYS . 0.3 OUTLIER -138.28 115.99 11.42 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.154 0.502 . . . . 0.0 111.359 -179.542 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 191' ' ' THR . . . . . 0.963 ' HB ' HG11 ' A' ' 40' ' ' VAL . 1.0 OUTLIER -90.61 44.31 1.19 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.565 179.201 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 192' ' ' CYS . . . . . 0.697 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.0 OUTLIER -52.72 172.37 0.05 OUTLIER 'General case' 0 CA--C 1.497 -1.073 0 CA-C-O 121.884 0.85 . . . . 0.0 111.587 -179.872 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 193' ' ' CYS . . . . . 0.697 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.1 OUTLIER 43.14 81.65 0.24 Allowed Pre-proline 0 N--CA 1.439 -1.003 0 CA-C-N 113.452 -1.704 . . . . 0.0 112.161 173.75 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 194' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -86.44 30.67 0.48 Allowed 'Trans proline' 0 N--CA 1.461 -0.384 0 C-N-CA 123.054 2.503 . . . . 0.0 112.781 -179.878 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -162.45 71.57 0.32 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.876 0.369 . . . . 0.0 110.664 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 196' ' ' THR . . . . . 0.657 ' N ' ' HD3' ' B' ' 197' ' ' PRO . 65.2 p -143.36 47.93 0.88 Allowed Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.871 -179.875 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 197' ' ' PRO . . . . . 0.657 ' HD3' ' N ' ' B' ' 196' ' ' THR . 6.3 Cg_exo -73.95 13.5 0.8 Allowed 'Trans proline' 0 C--N 1.351 0.683 0 C-N-CA 121.674 1.583 . . . . 0.0 108.742 175.941 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 198' ' ' TYR . . . . . 0.596 ' H ' ' C ' ' B' ' 196' ' ' THR . 63.9 t80 . . . . . 0 C--O 1.249 1.049 0 CA-C-N 113.929 -1.487 . . . . 0.0 111.291 -178.803 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . 0.539 HG23 ' H ' ' A' ' 2' ' ' VAL . 2.1 tp . . . . . 0 N--CA 1.486 1.37 0 CA-C-O 120.593 0.235 . . . . 0.0 111.1 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.704 HG23 HG22 ' A' ' 15' ' ' THR . 0.5 OUTLIER -178.97 -169.04 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.566 -0.288 . . . . 0.0 110.792 -179.933 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.634 ' N ' HG13 ' A' ' 2' ' ' VAL . 0.9 OUTLIER -147.16 -50.26 0.19 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.712 0.291 . . . . 0.0 111.302 179.971 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . 0.501 ' CD2' ' O ' ' A' ' 3' ' ' CYS . 3.4 p80 53.95 110.28 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.244 0.545 . . . . 0.0 111.029 -179.591 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.54 HG22 HG13 ' A' ' 14' ' ' VAL . 1.9 t -82.7 109.95 17.33 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.552 -179.029 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.624 HG23 ' HB3' ' A' ' 10' ' ' PRO . 4.0 m -93.55 17.77 11.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.356 179.659 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -59.76 84.78 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.785 0.326 . . . . 0.0 110.93 179.919 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 2.2 p 60.44 19.07 8.78 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.896 -179.711 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 2.5 p 168.8 104.29 0.04 OUTLIER Pre-proline 0 C--O 1.232 0.137 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.823 -179.914 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.752 ' O ' HG22 ' A' ' 11' ' ' ILE . 23.3 Cg_endo -85.69 -136.34 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.704 2.269 . . . . 0.0 111.45 179.804 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.752 HG22 ' O ' ' A' ' 10' ' ' PRO . 1.3 tt 55.27 0.08 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.286 0 N-CA-C 113.126 0.787 . . . . 0.0 113.126 179.616 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.48 ' H ' ' C ' ' A' ' 10' ' ' PRO . 0.1 OUTLIER -67.89 -43.74 78.62 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.761 0.315 . . . . 0.0 111.297 -179.504 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.798 ' O ' HG23 ' A' ' 15' ' ' THR . . . 58.99 44.42 16.36 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.005 0.431 . . . . 0.0 110.767 -179.639 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.54 HG13 HG22 ' A' ' 5' ' ' THR . 16.1 m -54.01 -39.13 39.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.366 -179.803 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.798 HG23 ' O ' ' A' ' 13' ' ' ALA . 1.8 p 62.71 147.76 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.893 -179.924 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.408 ' N ' ' HD3' ' A' ' 17' ' ' PRO . 6.8 t -128.53 57.63 29.68 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.599 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.613 ' N ' ' HD2' ' A' ' 18' ' ' PRO . 74.2 Cg_exo -47.0 -50.06 11.55 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.656 2.238 . . . . 0.0 112.981 179.592 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.613 ' HD2' ' N ' ' A' ' 17' ' ' PRO . 11.2 Cg_endo -55.37 -62.14 0.3 Allowed 'Trans proline' 0 C--N 1.349 0.575 0 C-N-CA 122.345 2.03 . . . . 0.0 112.498 -179.649 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.497 ' HA2' ' HA ' ' A' ' 46' ' ' ALA . . . -45.99 156.7 0.45 Allowed Glycine 0 C--N 1.331 0.25 0 C-N-CA 120.823 -0.703 . . . . 0.0 112.459 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.916 ' HG3' HD11 ' A' ' 22' ' ' LEU . 0.0 OUTLIER -99.4 48.96 0.94 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.031 0.444 . . . . 0.0 112.128 -179.314 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.547 ' C ' HD13 ' A' ' 22' ' ' LEU . 0.8 OUTLIER 77.72 60.52 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.744 -0.662 . . . . 0.0 112.441 178.357 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.916 HD11 ' HG3' ' A' ' 20' ' ' GLU . 0.0 OUTLIER -152.13 96.7 2.22 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 121.003 0.43 . . . . 0.0 111.605 178.366 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.562 ' HA ' ' HA ' ' A' ' 44' ' ' CYS . 9.5 m -87.77 44.81 1.22 Allowed 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.825 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.663 ' CD2' HG11 ' A' ' 57' ' ' VAL . 0.2 OUTLIER 35.29 -89.31 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 179.535 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.605 ' CB ' ' O ' ' A' ' 24' ' ' TYR . 12.5 ttm-85 107.08 -59.69 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.331 0.652 . . . . 0.0 111.835 -179.959 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.831 ' CA ' HG12 ' A' ' 57' ' ' VAL . 0.7 OUTLIER 61.53 123.89 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.541 -179.048 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 10.0 ptt? -144.41 137.59 27.13 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.003 0.43 . . . . 0.0 111.87 -179.65 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' TRP . . . . . 0.452 ' HB3' HG21 ' A' ' 39' ' ' VAL . 4.3 t90 -136.41 142.54 43.69 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.426 179.399 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . 0.476 ' HA ' ' CB ' ' A' ' 33' ' ' CYS . 33.8 t 69.94 11.13 7.67 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.51 -179.822 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -97.97 44.82 1.03 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.778 0.323 . . . . 0.0 111.072 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -178.3 -88.32 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.983 179.753 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -96.63 76.47 2.85 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.996 0.427 . . . . 0.0 110.077 179.526 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.476 ' CB ' ' HA ' ' A' ' 29' ' ' CYS . 7.2 t -161.15 156.49 24.43 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.798 -179.119 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -51.35 -54.3 27.73 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.96 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 2.6 m -86.43 168.29 13.91 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.614 179.755 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.419 ' CG ' ' O ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -100.51 63.12 1.08 Allowed 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.363 -179.637 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.446 ' N ' ' O ' ' A' ' 29' ' ' CYS . . . 78.46 144.26 2.47 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.436 -0.887 . . . . 0.0 113.118 179.498 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.59 ' HA ' ' HG2' ' A' ' 70' ' ' LYS . 0.0 OUTLIER 179.19 33.25 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.333 0.587 . . . . 0.0 109.83 179.574 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.452 HG21 ' HB3' ' A' ' 28' ' ' TRP . 46.2 t -143.27 134.54 23.22 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-N 115.295 -0.866 . . . . 0.0 110.128 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.623 HG12 ' CD2' ' A' ' 42' ' ' LEU . 0.1 OUTLIER -144.99 159.76 13.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 120.922 0.392 . . . . 0.0 111.328 -179.334 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.457 ' CB ' ' CB ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -157.19 42.81 0.34 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.12 -179.999 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.623 ' CD2' HG12 ' A' ' 40' ' ' VAL . 4.2 mm? -51.19 153.03 2.13 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.571 179.721 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 158.87 -6.04 0.14 Allowed Glycine 0 CA--C 1.52 0.345 0 C-N-CA 120.1 -1.048 . . . . 0.0 113.74 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.562 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 52.5 t 61.32 152.88 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 117.602 0.701 . . . . 0.0 111.496 179.752 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.574 ' O ' ' HB2' ' A' ' 46' ' ' ALA . . . -128.06 -79.37 0.58 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.743 179.745 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.575 ' CA ' HD21 ' A' ' 22' ' ' LEU . . . 168.01 -24.98 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.874 179.699 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 14.8 t -146.1 134.19 21.55 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.766 0.317 . . . . 0.0 111.438 -179.449 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.489 ' O ' ' N ' ' A' ' 50' ' ' SER . 11.3 m -78.99 -47.11 1.69 Allowed Pre-proline 0 C--N 1.333 -0.142 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.732 179.552 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.486 ' HD3' ' HB2' ' A' ' 48' ' ' CYS . 17.3 Cg_exo -65.97 59.76 0.44 Allowed 'Trans proline' 0 C--N 1.349 0.585 0 C-N-CA 122.335 2.024 . . . . 0.0 110.374 178.701 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.489 ' N ' ' O ' ' A' ' 48' ' ' CYS . 23.0 t -93.65 -41.23 9.83 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 115.231 -0.895 . . . . 0.0 111.018 -178.615 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.528 ' O ' ' CB ' ' A' ' 52' ' ' LYS . 4.3 mmtm -141.47 -80.12 0.25 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.712 179.747 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.71 ' HB2' ' HD3' ' A' ' 53' ' ' PRO . 4.9 mtpp 107.29 -56.92 0.0 OUTLIER Pre-proline 0 N--CA 1.474 0.759 0 C-N-CA 123.954 0.902 . . . . 0.0 111.355 179.735 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . 0.71 ' HD3' ' HB2' ' A' ' 52' ' ' LYS . 39.4 Cg_exo -59.83 -156.65 0.02 OUTLIER 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 122.06 1.84 . . . . 0.0 111.971 179.641 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.84 85.59 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.598 179.691 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 13.1 tt0 -106.9 -91.14 0.42 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.256 -179.704 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 174.59 -50.18 0.01 OUTLIER 'General case' 0 N--CA 1.456 -0.141 0 CA-C-O 121.004 0.431 . . . . 0.0 110.47 -179.509 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.831 HG12 ' CA ' ' A' ' 26' ' ' LYS . 30.1 m -92.54 178.24 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 115.844 -0.617 . . . . 0.0 111.554 -179.644 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.535 HG23 ' O ' ' A' ' 57' ' ' VAL . 0.4 OUTLIER -167.3 33.6 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.441 179.88 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 2.7 m 68.99 168.04 0.28 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.581 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.499 ' HB3' ' HB2' ' A' ' 23' ' ' CYS . 0.1 OUTLIER -162.18 36.14 0.12 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.742 0.306 . . . . 0.0 111.495 -179.374 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.549 ' C ' HG23 ' A' ' 62' ' ' THR . 0.1 OUTLIER -74.72 -163.0 0.18 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.655 0.264 . . . . 0.0 111.222 -179.916 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.549 HG23 ' C ' ' A' ' 61' ' ' SER . 1.4 p 77.71 27.99 0.58 Allowed 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.224 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 16.2 t70 60.68 149.66 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.572 179.288 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 29.53 87.39 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 115.631 -0.713 . . . . 0.0 112.517 179.57 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . 0.432 ' CB ' ' O ' ' A' ' 60' ' ' CYS . 49.0 t -123.4 -10.49 7.97 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.297 179.77 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.54 ' N ' ' HD2' ' A' ' 67' ' ' PRO . 12.3 m-80 -63.07 -57.06 22.87 Favored Pre-proline 0 CA--C 1.531 0.236 0 CA-C-N 116.578 -0.283 . . . . 0.0 111.534 -179.913 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . 0.54 ' HD2' ' N ' ' A' ' 66' ' ' ASN . 1.3 Cg_endo -42.83 165.4 0.03 OUTLIER 'Trans proline' 0 C--N 1.349 0.58 0 C-N-CA 122.992 2.461 . . . . 0.0 112.94 -179.65 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.52 ' N ' ' HD3' ' A' ' 69' ' ' PRO . 2.2 m-70 57.57 51.81 5.08 Favored Pre-proline 0 C--N 1.331 -0.197 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.064 -179.801 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.52 ' HD3' ' N ' ' A' ' 68' ' ' HIS . 96.6 Cg_endo -86.63 -47.6 0.04 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.595 0 C-N-CA 122.479 2.12 . . . . 0.0 113.105 -179.697 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.59 ' HG2' ' HA ' ' A' ' 38' ' ' LYS . 0.0 OUTLIER -179.01 -164.12 0.07 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.662 -179.051 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 56.94 -82.07 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 111.7 0.259 . . . . 0.0 111.7 179.441 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.428 ' N ' ' O ' ' A' ' 70' ' ' LYS . 15.0 ptp180 -57.49 146.13 65.49 Favored Pre-proline 0 C--N 1.33 -0.241 0 CA-C-O 120.627 0.251 . . . . 0.0 111.182 -179.526 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -58.89 83.34 0.05 OUTLIER 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.613 2.209 . . . . 0.0 112.113 179.868 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.031 0 CA-C-O 118.363 -1.243 . . . . 0.0 112.381 -179.905 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 181' ' ' TYR . . . . . . . . . . . . . 88.3 t80 . . . . . 0 N--CA 1.486 1.359 0 CA-C-O 120.75 0.31 . . . . 0.0 111.134 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 182' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -74.0 70.68 1.53 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.956 179.959 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 183' ' ' GLY . . . . . . . . . . . . . . . -136.09 178.89 18.39 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.391 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 184' ' ' TRP . . . . . . . . . . . . . 4.6 m95 59.52 100.14 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.787 0.327 . . . . 0.0 110.859 -179.944 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 185' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -140.77 -46.43 0.4 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.847 -179.895 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 186' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -117.14 104.23 11.01 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.953 179.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 187' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -62.23 -150.3 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.536 179.821 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 188' ' ' VAL . . . . . 0.421 ' HB ' ' CE1' ' B' ' 190' ' ' TYR . 0.2 OUTLIER -79.43 172.35 1.14 Allowed 'Isoleucine or valine' 0 N--CA 1.456 -0.169 0 CA-C-O 120.823 0.344 . . . . 0.0 110.941 -179.85 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 189' ' ' TYR . . . . . 0.401 ' H ' HG12 ' B' ' 188' ' ' VAL . 80.1 m-85 -85.75 136.98 33.12 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.249 -179.746 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 190' ' ' TYR . . . . . 0.447 ' CE2' ' HB2' ' A' ' 38' ' ' LYS . 24.3 m-85 -139.83 122.32 16.17 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.689 179.755 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 191' ' ' THR . . . . . 0.601 ' O ' HG22 ' B' ' 191' ' ' THR . 85.8 m -89.66 49.38 1.73 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.19 0.519 . . . . 0.0 111.177 179.885 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 192' ' ' CYS . . . . . 0.697 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.0 OUTLIER -90.07 172.56 8.75 Favored 'General case' 0 CA--C 1.498 -1.029 0 CA-C-O 121.752 0.787 . . . . 0.0 110.985 179.561 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 193' ' ' CYS . . . . . 0.697 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.1 OUTLIER 41.31 73.36 0.9 Allowed Pre-proline 0 C--N 1.314 -0.946 0 CA-C-N 113.625 -1.625 . . . . 0.0 112.172 173.706 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 194' ' ' PRO . . . . . 0.413 ' HB3' ' CG2' ' A' ' 6' ' ' THR . 36.2 Cg_endo -65.06 -87.42 0.0 OUTLIER 'Trans proline' 0 CA--C 1.531 0.331 0 C-N-CA 122.555 2.17 . . . . 0.0 112.391 -179.749 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 30.9 t0 -106.14 13.64 28.74 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.566 0.222 . . . . 0.0 111.539 -179.805 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 196' ' ' THR . . . . . 0.762 ' C ' ' H ' ' B' ' 198' ' ' TYR . 77.3 p -79.89 -22.32 0.36 Allowed Pre-proline 0 C--N 1.331 -0.208 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 179.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 197' ' ' PRO . . . . . 0.664 ' CD ' ' N ' ' B' ' 196' ' ' THR . 17.2 Cg_exo -64.73 27.87 0.08 OUTLIER 'Trans proline' 0 C--N 1.355 0.878 0 C-N-CA 121.329 1.353 . . . . 0.0 109.622 177.172 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 198' ' ' TYR . . . . . 0.762 ' H ' ' C ' ' B' ' 196' ' ' THR . 13.0 t80 . . . . . 0 C--O 1.249 1.026 0 CA-C-N 114.283 -1.326 . . . . 0.0 111.28 -178.739 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . 0.534 HG21 ' C ' ' A' ' 62' ' ' THR . 1.2 mm . . . . . 0 N--CA 1.487 1.419 0 CA-C-O 120.758 0.313 . . . . 0.0 110.781 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.814 ' CG2' HG22 ' A' ' 15' ' ' THR . 1.0 OUTLIER -96.41 146.95 6.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.921 -179.818 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 29.2 p -127.0 116.45 20.78 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 112.37 0.507 . . . . 0.0 112.37 -178.68 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . 0.746 ' HA ' ' HA ' ' A' ' 14' ' ' VAL . 0.6 OUTLIER -46.35 166.3 0.02 OUTLIER 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.278 179.163 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.731 HG23 ' O ' ' A' ' 13' ' ' ALA . 21.2 p -88.91 126.09 35.23 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.924 -179.843 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -121.04 28.82 7.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.069 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -48.26 -30.36 4.71 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 121.018 0.437 . . . . 0.0 111.046 179.797 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 88.0 m -165.61 -68.96 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.239 179.702 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.461 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER -102.75 169.39 7.56 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.173 179.506 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.55 ' HG3' ' CA ' ' B' ' 195' ' ' ASP . 9.7 Cg_endo -51.64 -47.54 25.79 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.365 2.043 . . . . 0.0 111.893 179.672 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.561 HG22 ' N ' ' A' ' 12' ' ' SER . 31.1 mm 64.14 -103.05 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.982 179.838 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.561 ' N ' HG22 ' A' ' 11' ' ' ILE . 4.1 t 162.95 -35.12 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.779 0.323 . . . . 0.0 110.79 179.892 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.731 ' O ' HG23 ' A' ' 5' ' ' THR . . . -57.81 111.12 1.05 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.658 -179.511 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.746 ' HA ' ' HA ' ' A' ' 4' ' ' HIS . 0.1 OUTLIER -97.66 169.19 1.52 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.727 179.674 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.814 HG22 ' CG2' ' A' ' 2' ' ' VAL . 1.2 p 74.59 158.28 0.2 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.595 -179.967 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.471 ' O ' ' HD3' ' A' ' 18' ' ' PRO . 0.0 OUTLIER 176.54 -48.76 0.0 OUTLIER Pre-proline 0 C--N 1.327 -0.379 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.225 -179.868 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.448 ' HB3' ' O ' ' A' ' 21' ' ' ASN . 69.3 Cg_endo -98.46 78.72 0.06 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.721 0 C-N-CA 123.111 2.541 . . . . 0.0 113.723 -178.448 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.471 ' HD3' ' O ' ' A' ' 16' ' ' CYS . 49.3 Cg_endo -68.56 162.86 39.1 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.013 1.809 . . . . 0.0 111.106 178.808 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 53.26 -88.45 0.01 OUTLIER Glycine 0 CA--C 1.519 0.295 0 C-N-CA 120.528 -0.844 . . . . 0.0 112.518 -179.866 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.433 ' N ' ' O ' ' A' ' 18' ' ' PRO . 14.5 mt-10 -140.07 111.82 7.41 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.807 0.337 . . . . 0.0 110.884 179.842 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.493 ' O ' ' C ' ' A' ' 22' ' ' LEU . 0.7 OUTLIER -178.5 34.09 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.081 179.904 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.789 HD23 ' O ' ' A' ' 47' ' ' THR . 0.2 OUTLIER -12.85 124.94 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 -179.822 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.746 ' HB3' HD21 ' A' ' 42' ' ' LEU . 0.1 OUTLIER -43.65 -29.41 0.5 Allowed 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.898 -179.691 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.509 ' CD2' ' HB2' ' A' ' 45' ' ' ALA . 0.2 OUTLIER 60.58 126.4 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.997 0.427 . . . . 0.0 111.344 179.51 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 3.0 ttt180 -117.21 78.06 1.18 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.801 179.75 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.529 ' HG2' HG12 ' A' ' 57' ' ' VAL . 2.9 mtmm -64.67 154.55 36.2 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.13 -179.83 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 1.8 ttm -157.5 100.45 1.8 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.52 179.862 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' TRP . . . . . 0.579 ' HE3' HG11 ' A' ' 39' ' ' VAL . 0.8 OUTLIER -56.42 -36.74 69.3 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.476 -179.544 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER 59.63 -168.4 0.15 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.826 0.346 . . . . 0.0 110.72 179.914 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 26.7 p-10 -91.71 -38.3 12.49 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.816 179.847 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -171.93 -56.08 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.809 179.855 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -131.96 17.48 4.64 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.974 179.58 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 93.0 m 56.84 165.76 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.945 0.402 . . . . 0.0 111.337 179.755 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 11.4 p 172.13 -34.16 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.499 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -161.36 -43.74 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.584 179.937 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.53 -172.22 1.75 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.967 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.472 ' O ' ' N ' ' A' ' 39' ' ' VAL . . . 169.69 -38.62 0.2 Allowed Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 121.141 -0.552 . . . . 0.0 111.887 -179.844 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.634 ' HA ' ' HB2' ' A' ' 70' ' ' LYS . 0.0 OUTLIER 22.92 -83.12 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 113.534 0.938 . . . . 0.0 113.534 179.673 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.715 ' HA ' ' O ' ' B' ' 189' ' ' TYR . 11.2 t -38.7 118.62 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 N-CA-C 112.664 0.616 . . . . 0.0 112.664 -178.617 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.563 HG13 ' O ' ' A' ' 38' ' ' LYS . 35.3 m -115.0 171.64 4.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.02 -179.83 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -173.96 33.96 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.339 179.901 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.878 HD12 ' HG3' ' A' ' 67' ' ' PRO . 0.6 OUTLIER -68.83 139.49 55.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.313 179.476 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 160.54 40.32 0.02 OUTLIER Glycine 0 C--N 1.332 0.354 0 C-N-CA 119.911 -1.138 . . . . 0.0 113.241 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.581 ' N ' ' O ' ' A' ' 23' ' ' CYS . 13.7 m 60.61 152.56 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.075 0.464 . . . . 0.0 111.659 179.045 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.525 ' O ' ' HB2' ' A' ' 46' ' ' ALA . . . -133.0 -77.97 0.49 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.997 179.96 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.525 ' HB2' ' O ' ' A' ' 45' ' ' ALA . . . 170.75 -31.26 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.347 179.924 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.789 ' O ' HD23 ' A' ' 22' ' ' LEU . 13.5 t -141.35 -165.55 1.99 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.345 -179.686 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.547 ' H ' ' HD2' ' A' ' 49' ' ' PRO . 34.5 t -148.03 -60.46 0.02 OUTLIER Pre-proline 0 C--N 1.331 -0.205 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.494 -179.993 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.547 ' HD2' ' H ' ' A' ' 48' ' ' CYS . 3.4 Cg_exo -39.66 -26.83 0.17 Allowed 'Trans proline' 0 C--N 1.353 0.77 0 C-N-CA 122.519 2.146 . . . . 0.0 111.52 179.083 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.477 ' HB2' HG23 ' A' ' 47' ' ' THR . 0.9 OUTLIER -41.47 136.05 1.89 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.42 178.708 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 170.63 59.81 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.915 0.388 . . . . 0.0 111.043 179.62 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.525 ' HB2' ' HD3' ' A' ' 53' ' ' PRO . 0.0 OUTLIER -97.14 -67.07 0.07 OUTLIER Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.101 179.878 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . 0.525 ' HD3' ' HB2' ' A' ' 52' ' ' LYS . 72.2 Cg_endo -76.14 166.52 27.66 Favored 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 122.132 1.888 . . . . 0.0 112.286 179.907 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -73.76 84.0 1.64 Allowed 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.935 179.998 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.407 ' CG ' ' HG2' ' A' ' 53' ' ' PRO . 0.6 OUTLIER -111.79 -138.41 0.38 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.048 -179.936 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.625 ' O ' HG22 ' A' ' 57' ' ' VAL . 0.5 OUTLIER -139.3 -102.48 0.17 Allowed 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.853 -179.51 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.625 HG22 ' O ' ' A' ' 56' ' ' GLU . 20.9 m 49.61 159.88 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.391 0 CA-C-O 121.376 0.607 . . . . 0.0 112.426 179.785 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -149.59 17.84 0.91 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.075 179.86 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 7.8 t 49.61 97.47 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.719 179.674 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.407 ' HB3' ' HB3' ' A' ' 23' ' ' CYS . 21.1 t -84.71 -108.71 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 179.162 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.67 ' CB ' HD12 ' A' ' 22' ' ' LEU . 2.8 p 69.62 -59.22 0.5 Allowed 'General case' 0 N--CA 1.463 0.191 0 N-CA-C 111.955 0.354 . . . . 0.0 111.955 179.187 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.534 ' C ' HG21 ' A' ' 1' ' ' ILE . 23.8 p -51.56 -173.55 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.938 0.399 . . . . 0.0 111.6 -179.403 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . 0.468 ' N ' HG21 ' A' ' 1' ' ' ILE . 2.0 p30 -39.88 160.1 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.754 -179.56 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 29.6 mtpt -40.73 92.49 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.484 -179.619 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . 0.438 ' N ' ' O ' ' A' ' 63' ' ' ASP . 4.1 m -38.75 -40.78 0.65 Allowed 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.247 -179.914 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.447 ' ND2' ' CE1' ' A' ' 4' ' ' HIS . 1.0 OUTLIER 43.23 55.29 11.21 Favored Pre-proline 0 N--CA 1.463 0.196 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.577 179.621 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . 0.878 ' HG3' HD12 ' A' ' 42' ' ' LEU . 58.9 Cg_endo -71.6 -8.32 22.97 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.424 2.083 . . . . 0.0 112.532 179.935 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 21.7 m170 60.19 158.83 0.11 Allowed Pre-proline 0 C--N 1.332 -0.189 0 CA-C-N 116.53 -0.304 . . . . 0.0 110.591 -179.835 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.509 ' HA ' ' OG1' ' B' ' 191' ' ' THR . 67.1 Cg_exo -43.65 -66.43 0.16 Allowed 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.601 2.201 . . . . 0.0 113.106 -179.45 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.634 ' HB2' ' HA ' ' A' ' 38' ' ' LYS . 0.0 OUTLIER -134.73 178.91 6.64 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 120.645 0.26 . . . . 0.0 110.939 -179.408 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.53 ' O ' ' HD2' ' A' ' 72' ' ' ARG . 14.5 tp60 -115.44 -11.24 11.86 Favored 'General case' 0 N--CA 1.463 0.218 0 N-CA-C 111.915 0.339 . . . . 0.0 111.915 -179.597 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.53 ' HD2' ' O ' ' A' ' 71' ' ' GLN . 0.0 OUTLIER 48.43 168.14 0.03 OUTLIER Pre-proline 0 N--CA 1.466 0.344 0 CA-C-O 121.1 0.476 . . . . 0.0 112.075 179.855 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.413 ' CD ' ' HB2' ' A' ' 72' ' ' ARG . 17.1 Cg_exo -67.52 136.22 38.84 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.682 2.255 . . . . 0.0 112.168 -179.56 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.092 0 CA-C-O 118.402 -1.221 . . . . 0.0 112.37 179.978 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 181' ' ' TYR . . . . . 0.444 ' O ' ' HG2' ' B' ' 182' ' ' ARG . 4.8 t80 . . . . . 0 N--CA 1.486 1.364 0 CA-C-O 120.746 0.308 . . . . 0.0 111.19 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 182' ' ' ARG . . . . . 0.444 ' HG2' ' O ' ' B' ' 181' ' ' TYR . 0.1 OUTLIER 60.74 152.32 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.03 179.988 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 183' ' ' GLY . . . . . . . . . . . . . . . -121.56 108.71 1.37 Allowed Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.579 -179.941 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 184' ' ' TRP . . . . . . . . . . . . . 3.6 p-90 -125.98 -37.87 2.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.771 0.319 . . . . 0.0 110.947 179.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 185' ' ' LYS . . . . . . . . . . . . . 8.4 tttt -138.71 132.28 30.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.717 179.806 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 186' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -153.55 37.16 0.46 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.943 -179.825 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 187' ' ' TRP . . . . . . . . . . . . . 88.2 m95 -80.27 159.79 25.74 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.012 0.434 . . . . 0.0 110.874 179.886 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -93.32 160.44 2.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.218 -179.743 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 189' ' ' TYR . . . . . 0.715 ' O ' ' HA ' ' A' ' 39' ' ' VAL . 0.1 OUTLIER -147.18 -101.56 0.09 Allowed 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.242 179.444 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 190' ' ' TYR . . . . . 0.462 ' H ' ' HB3' ' B' ' 189' ' ' TYR . 0.1 OUTLIER -79.69 149.21 31.29 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-O 120.94 0.4 . . . . 0.0 111.575 -179.91 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 191' ' ' THR . . . . . 0.509 ' OG1' ' HA ' ' A' ' 69' ' ' PRO . 0.2 OUTLIER -57.6 -162.94 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.287 -179.767 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 192' ' ' CYS . . . . . 0.724 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.2 OUTLIER -90.69 -60.81 1.82 Allowed 'General case' 0 CA--C 1.502 -0.871 0 CA-C-O 121.652 0.739 . . . . 0.0 112.431 -179.193 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 193' ' ' CYS . . . . . 0.724 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.0 OUTLIER -157.45 170.98 8.06 Favored Pre-proline 0 N--CA 1.438 -1.027 0 CA-C-N 114.055 -1.43 . . . . 0.0 111.737 -173.209 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 194' ' ' PRO . . . . . 0.489 ' HA ' ' HG2' ' A' ' 69' ' ' PRO . 1.5 Cg_endo -44.36 -70.85 0.06 OUTLIER 'Trans proline' 0 C--N 1.35 0.658 0 C-N-CA 123.149 2.566 . . . . 0.0 112.807 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 195' ' ' ASP . . . . . 0.55 ' CA ' ' HG3' ' A' ' 10' ' ' PRO . 0.6 OUTLIER -144.37 -85.73 0.13 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.004 -179.682 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 196' ' ' THR . . . . . 0.594 ' C ' ' H ' ' B' ' 198' ' ' TYR . 0.2 OUTLIER -157.06 43.53 0.18 Allowed Pre-proline 0 C--N 1.332 -0.185 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.817 -179.722 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 197' ' ' PRO . . . . . 0.491 ' CD ' ' N ' ' B' ' 196' ' ' THR . 72.7 Cg_endo -74.13 17.18 0.52 Allowed 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 121.627 1.551 . . . . 0.0 109.016 176.203 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 198' ' ' TYR . . . . . 0.594 ' H ' ' C ' ' B' ' 196' ' ' THR . 29.6 t80 . . . . . 0 C--O 1.249 1.064 0 CA-C-N 113.875 -1.512 . . . . 0.0 111.357 -178.781 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . 0.913 HG22 HD11 ' A' ' 22' ' ' LEU . 1.3 tp . . . . . 0 N--CA 1.487 1.407 0 CA-C-O 120.508 0.194 . . . . 0.0 111.079 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.686 HG12 HG13 ' A' ' 1' ' ' ILE . 9.9 p 177.08 147.0 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.517 -0.31 . . . . 0.0 110.847 179.902 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -154.9 131.1 10.31 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.77 0.319 . . . . 0.0 111.265 -179.847 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . 0.58 ' CA ' HG13 ' A' ' 14' ' ' VAL . 59.2 m-70 -48.69 171.75 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.944 179.712 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.748 ' CG2' ' HB3' ' A' ' 13' ' ' ALA . 0.8 OUTLIER -75.58 -167.46 0.68 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.661 -179.9 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.607 ' O ' ' HB3' ' A' ' 7' ' ' ALA . 9.6 t -46.07 -25.05 0.51 Allowed 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.364 179.819 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.607 ' HB3' ' O ' ' A' ' 6' ' ' THR . . . 83.36 78.89 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.534 179.71 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -87.4 -43.35 12.17 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.2 179.234 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.615 ' CB ' ' HD3' ' A' ' 10' ' ' PRO . 2.3 m -161.54 -78.54 0.01 OUTLIER Pre-proline 0 CA--C 1.535 0.375 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.905 179.308 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.615 ' HD3' ' CB ' ' A' ' 9' ' ' SER . 88.3 Cg_endo -80.11 -97.41 0.01 OUTLIER 'Trans proline' 0 C--N 1.353 0.808 0 C-N-CA 121.737 1.625 . . . . 0.0 112.312 179.646 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.609 HG23 ' O ' ' A' ' 10' ' ' PRO . 2.8 pt -161.72 162.67 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.335 -0.052 0 CA-C-O 120.655 0.264 . . . . 0.0 110.582 179.865 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.604 ' O ' HG23 ' A' ' 5' ' ' THR . 0.1 OUTLIER 176.35 148.54 0.11 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.013 0.435 . . . . 0.0 111.535 179.973 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.748 ' HB3' ' CG2' ' A' ' 5' ' ' THR . . . 43.9 42.51 4.62 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.803 -0.635 . . . . 0.0 112.01 179.373 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.608 ' C ' HG22 ' A' ' 15' ' ' THR . 2.0 t -65.18 101.81 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.491 179.638 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.631 ' HA ' HG23 ' A' ' 2' ' ' VAL . 0.0 OUTLIER 165.11 122.33 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.137 -179.393 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -114.75 83.11 8.77 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.009 -179.714 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.442 ' N ' ' CD ' ' A' ' 18' ' ' PRO . 28.4 Cg_exo -59.16 -47.94 15.75 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.332 2.021 . . . . 0.0 112.562 -179.988 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.442 ' CD ' ' N ' ' A' ' 17' ' ' PRO . 41.5 Cg_exo -56.74 175.1 0.32 Allowed 'Trans proline' 0 C--N 1.347 0.492 0 C-N-CA 122.394 2.063 . . . . 0.0 112.351 179.935 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 55.47 -166.69 3.2 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.872 -0.68 . . . . 0.0 112.819 179.756 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.785 ' N ' ' HB2' ' A' ' 46' ' ' ALA . 1.6 tt0 -159.8 22.93 0.18 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.636 0.255 . . . . 0.0 111.064 179.869 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.482 ' N ' ' O ' ' A' ' 45' ' ' ALA . 4.8 m120 -137.02 10.0 3.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.318 179.612 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.913 HD11 HG22 ' A' ' 1' ' ' ILE . 0.0 OUTLIER 70.11 -172.18 0.17 Allowed 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 112.846 0.684 . . . . 0.0 112.846 178.841 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.553 ' HA ' ' HA ' ' A' ' 44' ' ' CYS . 56.3 m -59.88 175.61 0.37 Allowed 'General case' 0 N--CA 1.46 0.048 0 CA-C-N 114.863 -1.062 . . . . 0.0 112.002 -179.738 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.603 ' CZ ' ' HB3' ' A' ' 45' ' ' ALA . 4.3 m-30 -119.17 -54.52 2.2 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.42 179.476 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.756 ' O ' HG13 ' A' ' 57' ' ' VAL . 0.0 OUTLIER 78.18 170.98 0.2 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.967 -179.041 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.494 ' CG ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER 177.95 74.93 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.447 -179.523 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 22.7 mtp -81.86 -176.37 6.07 Favored 'General case' 0 C--N 1.321 -0.644 0 C-N-CA 120.459 -0.496 . . . . 0.0 111.169 -179.416 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' TRP . . . . . 0.655 ' HB2' HG21 ' A' ' 39' ' ' VAL . 0.0 OUTLIER -133.38 86.93 2.34 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.503 179.885 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . 0.448 ' HA ' ' HG2' ' A' ' 36' ' ' ARG . 0.1 OUTLIER -148.34 66.29 1.08 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.587 -179.74 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.428 ' HB2' ' CZ3' ' A' ' 28' ' ' TRP . 1.2 t0 -52.08 90.51 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.845 -179.275 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . 38.9 -90.54 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.008 -0.542 . . . . 0.0 112.208 179.434 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.426 ' N ' ' O ' ' A' ' 30' ' ' ASP . 0.2 OUTLIER -64.07 79.7 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.983 0.42 . . . . 0.0 110.758 179.998 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 66.1 m -71.04 -73.44 0.17 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.909 -179.864 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.8 m 69.04 -64.8 0.31 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.918 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 45.7 m -137.55 53.89 1.84 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.974 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.448 ' HG2' ' HA ' ' A' ' 29' ' ' CYS . 2.1 tpt180 -100.29 -149.8 0.37 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.76 179.864 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -159.92 144.4 10.06 Favored Glycine 0 C--N 1.334 0.418 0 C-N-CA 120.294 -0.955 . . . . 0.0 112.844 -179.68 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.62 ' O ' HG23 ' B' ' 191' ' ' THR . 0.2 OUTLIER -73.2 102.65 3.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.135 0.493 . . . . 0.0 111.36 -179.759 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.707 HG13 ' O ' ' B' ' 189' ' ' TYR . 55.1 t -88.13 143.4 11.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.999 -179.928 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.626 ' CG1' HG22 ' B' ' 191' ' ' THR . 11.7 m -120.51 164.5 16.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.079 -179.639 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -175.79 -40.64 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.131 -179.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.489 HD11 ' ND2' ' A' ' 66' ' ' ASN . 0.5 OUTLIER 62.41 171.1 0.13 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.936 -179.845 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.414 ' HA3' ' HB2' ' A' ' 24' ' ' TYR . . . -159.52 -64.41 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.728 -0.748 . . . . 0.0 112.468 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.553 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 10.8 t 66.24 117.0 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.609 0.242 . . . . 0.0 110.814 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.603 ' HB3' ' CZ ' ' A' ' 24' ' ' TYR . . . -164.51 -170.32 2.0 Favored 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 120.618 -0.433 . . . . 0.0 111.83 -179.976 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.785 ' HB2' ' N ' ' A' ' 20' ' ' GLU . . . -132.17 34.55 3.78 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.215 -179.851 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.457 HG22 ' O ' ' A' ' 47' ' ' THR . 2.5 m -171.93 94.92 0.15 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.576 -179.691 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.48 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 1.8 t -147.24 46.06 0.47 Allowed Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.987 179.909 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.48 ' CD ' ' N ' ' A' ' 48' ' ' CYS . 87.0 Cg_endo -79.11 -5.38 14.43 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.396 2.064 . . . . 0.0 111.447 178.613 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 6.3 t -65.74 163.73 15.99 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.318 -179.703 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.559 ' O ' ' CB ' ' A' ' 52' ' ' LYS . 0.5 OUTLIER 172.36 175.35 0.09 Allowed 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.828 179.669 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.559 ' CB ' ' O ' ' A' ' 51' ' ' LYS . 4.8 mtpm? 115.79 -48.32 0.0 OUTLIER Pre-proline 0 N--CA 1.475 0.824 0 C-N-CA 124.171 0.989 . . . . 0.0 111.425 179.84 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . 0.504 ' HD3' ' HB2' ' A' ' 52' ' ' LYS . 24.9 Cg_exo -62.28 139.61 78.46 Favored 'Trans proline' 0 C--N 1.349 0.575 0 C-N-CA 122.131 1.887 . . . . 0.0 111.994 179.893 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -67.44 72.58 0.13 Allowed 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.865 -179.894 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -112.42 -174.46 2.46 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.89 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.593 ' O ' HG23 ' A' ' 58' ' ' THR . 11.1 tp10 -119.82 -21.22 7.29 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.512 -179.81 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.833 HG12 ' H ' ' A' ' 59' ' ' CYS . 60.9 t -48.01 -65.69 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.153 0 CA-C-O 121.385 0.612 . . . . 0.0 110.417 179.652 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.593 HG23 ' O ' ' A' ' 56' ' ' GLU . 4.1 p 59.65 8.71 1.35 Allowed 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.257 -0.883 . . . . 0.0 111.614 179.939 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . 0.833 ' H ' HG12 ' A' ' 57' ' ' VAL . 3.9 m 58.33 150.41 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.143 0 CA-C-O 121.011 0.434 . . . . 0.0 110.937 179.62 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.423 ' O ' ' O ' ' A' ' 21' ' ' ASN . 0.1 OUTLIER -122.26 138.18 54.59 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.08 -179.217 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.459 ' HA ' ' CB ' ' A' ' 22' ' ' LEU . 54.2 p -176.8 89.26 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.023 0.439 . . . . 0.0 111.062 179.572 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.451 HG22 ' C ' ' A' ' 61' ' ' SER . 0.6 OUTLIER 164.24 73.23 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.027 179.939 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . 0.445 ' H ' HG21 ' A' ' 1' ' ' ILE . 0.6 OUTLIER 63.64 178.39 0.16 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.283 -179.38 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.487 ' CG ' ' O ' ' A' ' 64' ' ' LYS . 0.0 OUTLIER -52.75 90.57 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.406 0.622 . . . . 0.0 110.921 -179.912 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . 0.41 ' N ' ' O ' ' A' ' 63' ' ' ASP . 8.0 p -101.13 -11.48 19.55 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.63 -179.463 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.544 HD21 ' HB2' ' A' ' 7' ' ' ALA . 49.6 t30 -52.96 126.59 43.25 Favored Pre-proline 0 C--N 1.328 -0.36 0 C-N-CA 121.019 -0.272 . . . . 0.0 111.101 -179.229 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -74.04 119.39 5.82 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.526 2.151 . . . . 0.0 112.639 -179.872 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.539 ' HB3' ' HD2' ' A' ' 69' ' ' PRO . 1.7 m80 -69.83 178.51 1.0 Allowed Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.156 -0.474 . . . . 0.0 109.724 179.355 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.608 ' HA ' HG21 ' B' ' 191' ' ' THR . 69.8 Cg_exo -43.17 148.16 0.65 Allowed 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.438 2.092 . . . . 0.0 112.515 -179.979 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.546 ' CB ' ' HB2' ' A' ' 38' ' ' LYS . 0.0 OUTLIER -46.16 135.45 7.71 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.035 0.445 . . . . 0.0 111.257 -179.305 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -126.06 -75.04 0.59 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.551 -178.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -42.28 151.49 0.35 Allowed Pre-proline 0 N--CA 1.465 0.314 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.566 -179.424 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_exo -48.85 163.27 0.31 Allowed 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.663 2.242 . . . . 0.0 112.694 -179.794 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.327 -1.263 . . . . 0.0 112.351 179.99 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 181' ' ' TYR . . . . . . . . . . . . . 1.4 t80 . . . . . 0 N--CA 1.486 1.334 0 CA-C-O 120.912 0.387 . . . . 0.0 111.201 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 182' ' ' ARG . . . . . . . . . . . . . 24.7 mmt85 59.72 72.61 0.52 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.926 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 183' ' ' GLY . . . . . . . . . . . . . . . -137.33 -149.01 5.51 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.525 -179.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 184' ' ' TRP . . . . . . . . . . . . . 3.4 p90 -161.88 128.98 3.88 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.77 0.319 . . . . 0.0 110.796 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 185' ' ' LYS . . . . . . . . . . . . . 2.0 tppt? -111.54 -75.44 0.61 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.914 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 186' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -97.48 62.66 1.72 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.122 -179.879 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 187' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -59.94 -160.41 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.663 179.793 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 188' ' ' VAL . . . . . 0.67 HG22 ' H ' ' B' ' 190' ' ' TYR . 3.5 p -79.85 130.67 35.68 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.547 0 CA-C-O 120.779 0.323 . . . . 0.0 110.583 179.942 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 189' ' ' TYR . . . . . 0.707 ' O ' HG13 ' A' ' 39' ' ' VAL . 0.1 OUTLIER -95.39 31.45 1.97 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.617 -179.304 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 190' ' ' TYR . . . . . 0.67 ' H ' HG22 ' B' ' 188' ' ' VAL . 0.1 OUTLIER -86.79 153.8 21.4 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.664 -0.244 . . . . 0.0 110.818 179.865 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 191' ' ' THR . . . . . 0.626 HG22 ' CG1' ' A' ' 40' ' ' VAL . 43.2 p -42.53 161.38 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 116.616 -0.266 . . . . 0.0 111.039 179.704 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 192' ' ' CYS . . . . . 0.704 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.0 OUTLIER -90.24 -64.72 1.1 Allowed 'General case' 0 CA--C 1.501 -0.932 0 N-CA-C 112.774 0.657 . . . . 0.0 112.774 -179.047 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 193' ' ' CYS . . . . . 0.704 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.0 OUTLIER -162.63 155.61 16.8 Favored Pre-proline 0 N--CA 1.439 -1.006 0 CA-C-N 114.736 -1.12 . . . . 0.0 112.15 -172.986 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 194' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -98.02 137.58 0.4 Allowed 'Trans proline' 0 N--CA 1.455 -0.778 0 C-N-CA 123.384 2.723 . . . . 0.0 112.981 -179.646 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 67.97 129.77 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 121.114 0.483 . . . . 0.0 111.767 179.044 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 196' ' ' THR . . . . . 0.601 HG22 ' O ' ' B' ' 196' ' ' THR . 52.0 m -160.11 44.48 0.17 Allowed Pre-proline 0 C--N 1.331 -0.235 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.304 179.645 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 197' ' ' PRO . . . . . 0.508 ' CD ' ' N ' ' B' ' 196' ' ' THR . 80.9 Cg_endo -74.93 14.31 0.87 Allowed 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 121.745 1.63 . . . . 0.0 108.919 176.234 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 198' ' ' TYR . . . . . 0.568 ' H ' ' C ' ' B' ' 196' ' ' THR . 59.3 t80 . . . . . 0 C--O 1.248 1.022 0 CA-C-N 113.896 -1.502 . . . . 0.0 111.299 -178.84 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . 0.583 ' CG2' ' C ' ' A' ' 62' ' ' THR . 9.7 mm . . . . . 0 N--CA 1.487 1.406 0 CA-C-O 120.817 0.342 . . . . 0.0 111.156 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.671 HG12 ' HA ' ' A' ' 15' ' ' THR . 0.0 OUTLIER 45.01 -171.64 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 CA-C-N 116.155 -0.475 . . . . 0.0 112.231 179.461 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.442 ' O ' ' O ' ' A' ' 4' ' ' HIS . 1.0 OUTLIER -148.09 125.73 11.79 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 116.554 -0.294 . . . . 0.0 110.81 -178.827 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . 0.622 ' N ' HG12 ' A' ' 14' ' ' VAL . 4.2 m-70 -37.83 162.95 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 112.073 0.397 . . . . 0.0 112.073 -179.809 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.926 HG23 ' CB ' ' A' ' 12' ' ' SER . 0.2 OUTLIER -137.85 163.36 31.62 Favored 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 112.452 0.538 . . . . 0.0 112.452 -178.354 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.571 ' O ' ' HB3' ' A' ' 7' ' ' ALA . 8.4 p 67.23 -43.34 0.45 Allowed 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 115.378 -0.828 . . . . 0.0 111.674 -179.749 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.571 ' HB3' ' O ' ' A' ' 6' ' ' THR . . . 77.07 -179.76 0.14 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.725 0.298 . . . . 0.0 110.782 -179.678 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.429 ' O ' HG22 ' A' ' 8' ' ' THR . 9.3 m 55.73 21.01 4.34 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.466 -0.333 . . . . 0.0 110.552 -179.453 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.45 ' OG ' HG22 ' A' ' 11' ' ' ILE . 7.0 t 167.52 143.92 0.06 OUTLIER Pre-proline 0 CA--C 1.53 0.196 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.604 -179.818 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.419 ' HA ' ' CE1' ' A' ' 4' ' ' HIS . 60.9 Cg_endo -82.51 -20.16 5.95 Favored 'Trans proline' 0 C--N 1.344 0.308 0 C-N-CA 123.049 2.499 . . . . 0.0 112.04 179.719 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.45 HG22 ' OG ' ' A' ' 9' ' ' SER . 14.4 tt -37.8 -26.92 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 N-CA-C 113.699 1.0 . . . . 0.0 113.699 -179.255 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.926 ' CB ' HG23 ' A' ' 5' ' ' THR . 0.8 OUTLIER -80.61 5.46 15.42 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.68 0.276 . . . . 0.0 111.7 -179.275 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.599 ' O ' HG13 ' A' ' 14' ' ' VAL . . . 56.81 -116.78 1.0 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.585 -179.967 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.622 HG12 ' N ' ' A' ' 4' ' ' HIS . 4.4 m -159.82 125.02 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.428 0 CA-C-O 120.754 0.312 . . . . 0.0 110.93 -179.503 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.671 ' HA ' HG12 ' A' ' 2' ' ' VAL . 0.5 OUTLIER 176.78 142.95 0.08 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.96 179.952 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 5.0 t -158.98 74.29 3.46 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.958 -179.926 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.474 ' N ' ' CD ' ' A' ' 18' ' ' PRO . 31.2 Cg_exo -58.37 -45.52 30.2 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 122.612 2.208 . . . . 0.0 112.743 -179.838 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.474 ' CD ' ' N ' ' A' ' 17' ' ' PRO . 81.0 Cg_exo -47.56 -63.75 0.3 Allowed 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 122.535 2.157 . . . . 0.0 112.527 -179.891 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -99.43 146.84 18.14 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.186 179.805 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -138.41 29.43 2.43 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.614 0.245 . . . . 0.0 111.199 -179.742 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -141.02 85.39 1.98 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.222 -179.934 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.703 HD12 ' N ' ' A' ' 48' ' ' CYS . 1.4 mt 62.62 123.5 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.574 -0.284 . . . . 0.0 111.537 178.952 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.599 ' HA ' ' HA ' ' A' ' 44' ' ' CYS . 3.8 m -71.8 157.84 37.17 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-O 120.973 0.416 . . . . 0.0 110.788 179.861 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.666 ' HA ' ' HB2' ' A' ' 45' ' ' ALA . 0.8 OUTLIER -65.31 65.3 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.778 -0.646 . . . . 0.0 112.012 -178.97 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.401 ' N ' ' O ' ' A' ' 23' ' ' CYS . 1.1 ttt85 -57.58 82.16 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.906 0.384 . . . . 0.0 110.45 179.215 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.501 ' HA ' ' O ' ' A' ' 56' ' ' GLU . 32.8 tttt -85.18 156.59 20.94 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.383 -179.231 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -177.34 100.84 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.764 179.708 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 34.4 t-105 -56.86 -75.27 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.776 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 1.1 m 49.83 81.09 0.06 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.4 179.257 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -62.5 99.38 0.14 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.713 179.737 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . 63.76 -79.55 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.974 -179.75 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -97.32 138.56 34.59 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.601 179.664 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 22.7 m -84.93 -79.08 0.23 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.069 -179.788 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 38.7 t 64.99 -74.76 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.936 -179.904 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.413 ' HA ' ' HE2' ' A' ' 70' ' ' LYS . 1.0 OUTLIER 179.65 29.68 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.09 179.809 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -119.28 -3.16 10.55 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.528 -179.803 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -124.17 54.76 0.72 Allowed Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.57 -0.824 . . . . 0.0 113.307 -179.23 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.469 ' HG2' ' HG3' ' A' ' 70' ' ' LYS . 0.1 OUTLIER -92.05 26.16 2.58 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.719 0.26 . . . . 0.0 111.192 179.625 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.518 ' O ' HG22 ' A' ' 40' ' ' VAL . 47.8 t -48.93 -61.07 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 CA-C-O 120.881 0.372 . . . . 0.0 110.933 179.788 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.518 HG22 ' O ' ' A' ' 39' ' ' VAL . 18.7 m 45.48 -174.92 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.759 -0.655 . . . . 0.0 112.164 179.483 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.451 ' O ' HD12 ' A' ' 42' ' ' LEU . 5.8 tp10 -177.08 -70.85 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.596 -179.953 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.744 HD22 ' HB3' ' A' ' 65' ' ' CYS . 0.6 OUTLIER 66.18 137.48 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.335 179.378 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.481 ' O ' ' HB2' ' A' ' 44' ' ' CYS . . . 161.91 50.1 0.02 OUTLIER Glycine 0 CA--C 1.521 0.459 0 C-N-CA 120.41 -0.9 . . . . 0.0 113.542 -179.993 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.599 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 1.7 m 70.77 118.28 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 112.635 0.606 . . . . 0.0 112.635 179.034 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.666 ' HB2' ' HA ' ' A' ' 24' ' ' TYR . . . -122.48 174.29 7.14 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.537 179.614 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.891 ' O ' HG22 ' A' ' 47' ' ' THR . . . -101.76 78.71 1.85 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.479 179.77 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.891 HG22 ' O ' ' A' ' 46' ' ' ALA . 3.5 t 61.79 173.26 0.12 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.637 -0.71 . . . . 0.0 111.507 -179.727 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.703 ' N ' HD12 ' A' ' 22' ' ' LEU . 6.0 m -69.74 -50.77 17.06 Favored Pre-proline 0 C--N 1.331 -0.224 0 CA-C-N 116.089 -0.505 . . . . 0.0 112.287 -179.031 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.609 ' HD2' HG23 ' A' ' 47' ' ' THR . 42.3 Cg_exo -34.1 80.82 0.0 OUTLIER 'Trans proline' 0 C--N 1.353 0.787 0 C-N-CA 122.663 2.242 . . . . 0.0 111.622 179.838 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.676 ' N ' ' O ' ' A' ' 48' ' ' CYS . 3.6 t -161.26 -34.77 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.12 -0.945 . . . . 0.0 111.208 -177.571 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.626 ' CG ' HG22 ' A' ' 58' ' ' THR . 0.1 OUTLIER -43.08 -55.85 3.66 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.83 -179.492 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.454 ' CB ' ' CD ' ' A' ' 53' ' ' PRO . 0.0 OUTLIER -45.99 -65.68 0.63 Allowed Pre-proline 0 C--N 1.331 -0.21 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.074 -179.75 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . 0.454 ' CD ' ' CB ' ' A' ' 52' ' ' LYS . 32.7 Cg_endo -64.58 -154.12 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.088 1.858 . . . . 0.0 110.965 178.916 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -45.0 93.7 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.694 0 CA-C-O 120.954 0.406 . . . . 0.0 110.843 179.671 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.497 ' O ' ' CG ' ' A' ' 56' ' ' GLU . 0.0 OUTLIER -61.33 -155.55 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.453 -179.062 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.501 ' O ' ' HA ' ' A' ' 26' ' ' LYS . 2.5 pt-20 58.34 41.28 23.4 Favored 'General case' 0 CA--C 1.527 0.091 0 CA-C-O 121.369 0.604 . . . . 0.0 110.546 -178.898 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 47.6 t -159.61 -50.49 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.092 -0.958 . . . . 0.0 109.674 179.418 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.626 HG22 ' CG ' ' A' ' 51' ' ' LYS . 53.0 p 32.88 -91.41 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 115.002 -0.999 . . . . 0.0 112.711 179.38 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . 0.457 ' HB2' ' HB3' ' A' ' 22' ' ' LEU . 0.8 OUTLIER -179.78 155.94 0.66 Allowed 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.4 -179.373 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.544 ' SG ' HD23 ' A' ' 42' ' ' LEU . 0.0 OUTLIER -130.71 4.3 4.57 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 112.06 0.392 . . . . 0.0 112.06 -179.434 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.546 ' CA ' ' HA ' ' A' ' 22' ' ' LEU . 82.4 p 44.63 -162.26 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.241 0 N-CA-C 110.22 -0.289 . . . . 0.0 110.22 -179.17 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.583 ' C ' ' CG2' ' A' ' 1' ' ' ILE . 71.4 p -99.03 123.05 43.06 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 179.291 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 5.1 p30 167.67 179.19 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.908 0.385 . . . . 0.0 111.046 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.4 ' O ' ' ND2' ' A' ' 66' ' ' ASN . 0.0 OUTLIER -80.67 58.67 3.35 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.395 179.52 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . 0.744 ' HB3' HD22 ' A' ' 42' ' ' LEU . 0.6 OUTLIER -59.49 -70.88 0.14 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.613 179.983 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.617 ' C ' HD13 ' A' ' 42' ' ' LEU . 14.2 p30 49.69 161.64 0.04 OUTLIER Pre-proline 0 N--CA 1.463 0.22 0 CA-C-N 115.576 -0.738 . . . . 0.0 112.413 179.761 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . 0.538 ' CB ' HG21 ' B' ' 191' ' ' THR . 16.9 Cg_exo -68.64 62.16 1.2 Allowed 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 123.193 2.596 . . . . 0.0 112.6 -179.6 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 56.7 p-80 -59.22 109.39 1.87 Allowed Pre-proline 0 C--N 1.328 -0.369 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.702 179.76 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.442 ' HG3' ' HA ' ' B' ' 192' ' ' CYS . 52.4 Cg_exo -53.3 124.72 16.36 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.305 2.003 . . . . 0.0 111.989 -179.917 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.469 ' HG3' ' HG2' ' A' ' 38' ' ' LYS . 0.0 OUTLIER -90.79 -2.99 57.75 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.728 -179.487 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.419 ' HB2' ' CE ' ' A' ' 38' ' ' LYS . 31.7 tt0 -61.32 -17.98 56.36 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.612 -0.267 . . . . 0.0 111.379 -179.887 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.429 ' H ' ' HG3' ' A' ' 72' ' ' ARG . 0.0 OUTLIER -100.14 102.65 18.75 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-O 120.621 0.248 . . . . 0.0 111.079 -179.86 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_endo -79.93 172.86 13.48 Favored 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.615 2.21 . . . . 0.0 112.295 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.084 0 CA-C-O 118.323 -1.265 . . . . 0.0 112.586 -179.938 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 181' ' ' TYR . . . . . . . . . . . . . 15.8 t80 . . . . . 0 N--CA 1.485 1.304 0 CA-C-O 120.879 0.371 . . . . 0.0 111.058 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 182' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -144.88 -168.81 3.02 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.896 179.844 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 183' ' ' GLY . . . . . . . . . . . . . . . -155.67 -44.4 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.511 -179.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 184' ' ' TRP . . . . . 0.45 ' O ' ' CB ' ' B' ' 185' ' ' LYS . 48.2 p-90 -74.84 -178.76 3.85 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.651 0.262 . . . . 0.0 110.931 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 185' ' ' LYS . . . . . 0.45 ' CB ' ' O ' ' B' ' 184' ' ' TRP . 0.2 OUTLIER 86.99 -40.84 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.247 179.919 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 186' ' ' HIS . . . . . 0.412 ' N ' ' HG2' ' B' ' 185' ' ' LYS . 12.8 t60 -80.23 -30.4 38.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.788 0.328 . . . . 0.0 110.986 -179.983 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 187' ' ' TRP . . . . . . . . . . . . . 48.8 m0 -58.54 178.69 0.1 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.105 -179.861 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -79.76 158.33 4.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.055 -179.757 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 189' ' ' TYR . . . . . 0.427 ' O ' ' HA ' ' A' ' 39' ' ' VAL . 0.6 OUTLIER -156.24 -26.44 0.1 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.682 -179.798 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 190' ' ' TYR . . . . . 0.444 ' HA ' ' O ' ' A' ' 38' ' ' LYS . 0.1 OUTLIER -160.12 125.84 4.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.731 0.301 . . . . 0.0 111.274 -179.538 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 191' ' ' THR . . . . . 0.538 HG21 ' CB ' ' A' ' 67' ' ' PRO . 2.0 m -90.02 76.73 6.97 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.319 179.39 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 192' ' ' CYS . . . . . 0.717 ' SG ' ' N ' ' B' ' 193' ' ' CYS . 0.0 OUTLIER -90.57 174.13 7.69 Favored 'General case' 0 CA--C 1.499 -0.999 0 CA-C-O 122.162 0.982 . . . . 0.0 111.87 -179.152 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 193' ' ' CYS . . . . . 0.717 ' N ' ' SG ' ' B' ' 192' ' ' CYS . 0.1 OUTLIER 43.93 81.41 0.25 Allowed Pre-proline 0 N--CA 1.441 -0.896 0 CA-C-N 113.114 -1.857 . . . . 0.0 112.6 173.507 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 194' ' ' PRO . . . . . 0.406 ' O ' ' CD ' ' A' ' 10' ' ' PRO . 96.2 Cg_endo -83.36 -43.27 0.08 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.552 0 C-N-CA 122.69 2.26 . . . . 0.0 112.213 179.591 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -43.48 98.88 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.498 -179.948 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 196' ' ' THR . . . . . 0.7 ' N ' ' HD3' ' B' ' 197' ' ' PRO . 2.9 p -149.83 45.42 0.36 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.821 179.868 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 197' ' ' PRO . . . . . 0.7 ' HD3' ' N ' ' B' ' 196' ' ' THR . 2.5 Cg_endo -77.17 11.61 2.02 Favored 'Trans proline' 0 N--CA 1.455 -0.773 0 C-N-CA 121.851 1.701 . . . . 0.0 108.537 175.981 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 198' ' ' TYR . . . . . 0.534 ' H ' ' C ' ' B' ' 196' ' ' THR . 10.9 t80 . . . . . 0 C--O 1.249 1.063 0 CA-C-N 113.746 -1.57 . . . . 0.0 111.27 -178.796 . . . . . . . . 1 1 . 1 stop_ save_