data_1yur_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 1yur _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.8 mtt . . . . . 0 N--CA 1.473 0.713 0 N-CA-C 107.266 -1.383 . . . . 10.0 107.266 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -155.7 144.54 20.51 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 107.218 -1.401 . . . . 10.0 107.218 176.122 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -157.43 54.29 0.49 Allowed 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 109.551 -0.537 . . . . 10.0 109.551 165.479 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 25.2 pm0 -126.97 152.8 76.08 Favored Pre-proline 0 N--CA 1.45 -0.453 0 C-N-CA 125.118 1.367 . . . . 10.0 109.418 -179.299 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_endo -75.66 67.29 6.49 Favored 'Trans proline' 0 N--CA 1.449 -1.134 0 C-N-CA 122.718 2.279 . . . . 10.0 109.472 173.038 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.3 pp -78.58 156.69 29.02 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 109.031 -0.729 . . . . 10.0 109.031 171.531 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 8.4 m -135.89 158.36 44.58 Favored 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 105.428 -2.064 . . . . 10.0 105.428 174.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -44.07 -43.61 6.96 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.743 1.617 . . . . 10.0 112.933 -172.199 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -59.19 -53.86 53.51 Favored 'General case' 0 CA--C 1.534 0.352 0 O-C-N 121.629 -0.669 . . . . 10.0 109.576 177.502 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.61 -47.15 77.01 Favored 'General case' 0 C--O 1.227 -0.09 0 N-CA-C 108.723 -0.843 . . . . 10.0 108.723 178.936 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 19.5 tt0 -56.56 -41.08 76.27 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 124.361 1.064 . . . . 10.0 110.709 179.59 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 40.1 m -63.82 -44.2 93.95 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 108.349 -0.982 . . . . 10.0 108.349 -179.369 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 43.9 mt -66.97 -49.0 77.87 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 CA-C-N 115.451 -0.795 . . . . 10.0 110.329 -176.474 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.59 -41.05 84.88 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 117.94 0.336 . . . . 10.0 110.185 178.54 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 91.4 m -56.09 -55.0 38.31 Favored 'General case' 0 CA--C 1.53 0.173 0 CA-C-O 119.301 -0.381 . . . . 10.0 110.24 173.176 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 55.8 t -53.72 -56.41 9.05 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.28 0 CA-C-N 119.463 1.029 . . . . 10.0 110.49 179.693 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 33.3 m -59.93 -43.95 93.4 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 C-N-CA 120.144 -0.622 . . . . 10.0 111.281 -174.252 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -64.27 -36.64 84.76 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 109.929 -0.397 . . . . 10.0 109.929 178.686 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 99.5 m -62.45 -27.12 68.89 Favored 'General case' 0 CA--C 1.534 0.332 0 O-C-N 121.653 -0.654 . . . . 10.0 112.216 -178.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 52.5 m-85 -56.65 -37.59 70.99 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 120.314 1.415 . . . . 10.0 111.054 168.664 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -72.78 -57.82 3.8 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.935 0.894 . . . . 10.0 108.637 174.89 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 4.4 m -82.96 59.43 4.89 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 108.182 -1.044 . . . . 10.0 108.182 179.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 23.2 t80 -84.07 -57.6 3.12 Favored 'General case' 0 N--CA 1.454 -0.228 0 N-CA-C 107.958 -1.127 . . . . 10.0 107.958 -174.282 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -159.69 57.67 0.38 Allowed 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 107.132 -1.432 . . . . 10.0 107.132 164.008 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 5.7 tmm_? 58.44 93.06 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.799 1.24 . . . . 10.0 108.749 -168.276 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -137.52 98.36 3.68 Favored 'General case' 0 N--CA 1.455 -0.209 0 O-C-N 121.601 -0.687 . . . . 10.0 111.677 -171.867 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 11.8 mp0 -81.82 158.56 24.04 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 125.08 1.352 . . . . 10.0 107.849 173.196 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 56.26 38.18 76.71 Favored Glycine 0 CA--C 1.53 1.017 0 N-CA-C 112.142 -0.383 . . . . 10.0 112.142 -179.509 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.36 133.16 35.38 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 106.597 -1.631 . . . . 10.0 106.597 178.007 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 44.7 mtmt -81.69 -108.85 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 107.603 -1.258 . . . . 10.0 107.603 -179.255 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -97.5 -124.08 0.14 Allowed 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 106.807 -1.553 . . . . 10.0 106.807 169.675 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 20.1 t -82.22 -162.43 0.56 Allowed 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.194 0.998 . . . . 10.0 109.802 172.311 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -94.53 -161.19 0.83 Allowed 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 125.263 1.425 . . . . 10.0 108.958 -172.792 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -86.97 165.19 16.05 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 109.296 -0.631 . . . . 10.0 109.296 170.214 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 56.0 t -73.11 -54.14 16.52 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 O-C-N 121.289 -0.882 . . . . 10.0 112.477 -168.699 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -62.86 -47.01 85.21 Favored 'General case' 0 N--CA 1.468 0.46 0 O-C-N 120.938 -1.101 . . . . 10.0 109.107 179.073 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 69.2 tt0 -43.8 -58.91 2.48 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 125.89 1.676 . . . . 10.0 109.77 173.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 9.5 t80 -44.93 -54.03 6.95 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.946 0.899 . . . . 10.0 111.663 171.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 3.4 tmtt? -54.78 -42.49 71.79 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 118.302 0.501 . . . . 10.0 111.52 179.371 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 -70.92 -35.27 72.19 Favored 'General case' 0 CA--C 1.532 0.287 0 O-C-N 121.724 -0.61 . . . . 10.0 111.955 178.539 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 51.0 mt -63.86 -55.08 25.51 Favored 'General case' 0 N--CA 1.453 -0.29 0 O-C-N 121.768 -0.582 . . . . 10.0 110.205 175.292 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 35.1 m -56.19 -45.54 80.98 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 O-C-N 120.686 -1.259 . . . . 10.0 111.864 -174.423 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 15.0 t -60.58 -22.94 64.26 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 119.285 0.948 . . . . 10.0 112.744 177.528 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -80.15 -53.63 6.51 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 108.732 -0.84 . . . . 10.0 108.732 175.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.27 -32.76 71.47 Favored 'General case' 0 C--O 1.233 0.188 0 C-N-CA 124.399 1.08 . . . . 10.0 111.7 -175.874 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 6.4 mp -95.48 85.56 0.29 Allowed Pre-proline 0 CA--C 1.535 0.391 0 C-N-CA 125.339 1.455 . . . . 10.0 109.039 172.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -71.08 -13.13 31.17 Favored 'Trans proline' 0 N--CA 1.458 -0.612 0 C-N-CA 121.671 1.581 . . . . 10.0 112.506 175.082 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 55.9 t60 -54.43 -57.3 11.84 Favored 'General case' 0 CA--C 1.532 0.261 0 N-CA-C 114.087 1.143 . . . . 10.0 114.087 -157.23 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.3 tt -152.23 -60.13 0.16 Allowed 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 118.954 0.797 . . . . 10.0 111.857 -174.201 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.5 mm? 67.57 62.43 0.43 Allowed 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 125.261 1.424 . . . . 10.0 109.955 -174.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.91 -33.83 33.89 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 124.124 0.969 . . . . 10.0 111.509 175.231 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . 0.255 1.4 m-20 28.41 93.23 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 130.976 3.711 . . . . 10.0 116.906 167.948 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 13.3 p -133.79 159.3 42.57 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.351 0 C-N-CA 123.204 0.602 . . . . 10.0 111.069 175.047 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 76.28 -98.85 1.26 Allowed Glycine 0 CA--C 1.522 0.517 0 N-CA-C 108.944 -1.662 . . . . 10.0 108.944 -174.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 22.8 m -63.06 -18.39 63.32 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 113.01 0.744 . . . . 10.0 113.01 -174.509 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -41.54 -55.88 2.73 Favored 'General case' 0 N--CA 1.457 -0.088 0 CA-C-N 118.479 0.581 . . . . 10.0 109.444 165.314 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -63.23 -52.2 63.18 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 116.267 -0.424 . . . . 10.0 110.562 -175.537 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -45.45 -54.81 6.88 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 124.453 1.101 . . . . 10.0 111.061 175.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -65.32 -45.63 83.53 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 123.665 0.786 . . . . 10.0 109.162 -176.754 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 28.3 ttt -51.64 -52.6 46.54 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 118.659 -0.686 . . . . 10.0 109.816 178.072 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . 0.254 0.0 OUTLIER -63.47 -41.19 98.61 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 118.844 -1.143 . . . . 10.0 110.758 179.496 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 34.3 m -55.51 -42.66 74.8 Favored 'General case' 0 CA--C 1.532 0.265 0 O-C-N 121.847 -0.533 . . . . 10.0 111.226 179.583 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.35 -50.84 58.23 Favored 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 109.265 -0.642 . . . . 10.0 109.265 174.425 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -47.03 -45.58 21.47 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.602 1.161 . . . . 10.0 112.869 -177.577 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 42.7 t -42.94 -69.08 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.384 0 C-N-CA 124.859 1.264 . . . . 10.0 112.319 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 58.8 m-80 -148.94 59.39 1.05 Allowed 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 122.912 0.485 . . . . 10.0 110.957 -178.655 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -57.45 -21.37 36.62 Favored 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 114.892 1.442 . . . . 10.0 114.892 178.623 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -51.92 -33.42 37.11 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 123.527 0.731 . . . . 10.0 110.738 172.557 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 16.5 m -50.78 148.0 4.4 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 121.914 0.864 . . . . 10.0 111.674 174.276 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 74.2 mt-10 -63.04 149.21 45.59 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 115.088 -0.96 . . . . 10.0 109.089 164.015 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 37.8 tp -94.13 157.62 15.99 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 106.793 -1.558 . . . . 10.0 106.793 162.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 45.9 mttp -137.65 152.08 48.96 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 118.49 0.586 . . . . 10.0 110.046 173.342 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 48.0 p90 -49.32 -42.96 43.07 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 124.465 1.106 . . . . 10.0 113.63 -163.071 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 17.5 p-10 -63.38 -37.88 88.99 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.201 0.601 . . . . 10.0 111.335 -179.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -78.45 -46.97 18.45 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 122.965 0.506 . . . . 10.0 109.761 -179.189 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -40.37 -50.31 2.83 Favored 'General case' 0 C--N 1.339 0.132 0 C-N-CA 124.06 0.944 . . . . 10.0 108.833 166.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER -47.23 -70.33 0.1 Allowed 'General case' 0 N--CA 1.445 -0.724 0 C-N-CA 123.111 0.564 . . . . 10.0 111.63 178.587 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 65.5 mtm-85 -39.52 -51.49 2.18 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.256 0.622 . . . . 10.0 111.46 174.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 5.3 mp -61.29 -45.05 96.08 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-O 118.716 -0.659 . . . . 10.0 112.289 -176.367 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 2.5 pt -69.48 -28.6 38.62 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.358 0 CA-C-N 120.376 1.444 . . . . 10.0 110.299 175.627 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -54.25 -54.62 30.87 Favored Glycine 0 C--N 1.335 0.526 0 N-CA-C 110.319 -1.112 . . . . 10.0 110.319 170.636 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -53.53 -44.11 68.91 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 115.123 -0.538 . . . . 10.0 110.618 171.584 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 20.0 tp -57.23 -47.69 80.72 Favored 'General case' 0 CA--C 1.536 0.419 0 O-C-N 121.298 -0.876 . . . . 10.0 112.518 175.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -56.92 -47.44 80.6 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 120.492 1.496 . . . . 10.0 111.288 173.679 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 42.6 tttt -55.85 -33.33 64.42 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.618 1.567 . . . . 10.0 112.292 177.151 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 23.0 mt-10 -74.62 -79.62 0.09 Allowed 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 127.337 2.255 . . . . 10.0 109.08 169.454 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -81.56 84.11 1.53 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.244 0 CA-C-O 122.8 1.286 . . . . 10.0 110.041 -173.556 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 49.2 mtt180 -81.16 105.87 12.7 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 115.198 -0.91 . . . . 10.0 108.595 179.104 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . 0.401 ' NZ ' ' OE2' ' B' ' 10' ' ' GLU . 0.3 OUTLIER -48.01 121.76 4.52 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 108.013 -1.106 . . . . 10.0 108.013 169.341 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 65.9 tttp -56.17 -44.99 79.87 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 117.825 0.284 . . . . 10.0 110.71 -174.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 46.7 tttm -167.67 -61.75 0.03 OUTLIER 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 107.902 -1.147 . . . . 10.0 107.902 170.205 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -114.04 62.8 0.66 Allowed 'General case' 0 C--O 1.225 -0.215 0 C-N-CA 124.186 0.994 . . . . 10.0 108.777 -165.602 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -46.2 -40.7 11.68 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 114.255 1.205 . . . . 10.0 114.255 -170.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 38.7 mttp -54.62 -21.02 9.26 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 113.394 0.887 . . . . 10.0 113.394 179.336 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 10.5 tt -56.64 -19.43 8.88 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 C-N-CA 123.702 0.801 . . . . 10.0 112.533 171.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 78.31 -60.05 0.41 Allowed 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 125.695 1.598 . . . . 10.0 109.148 -178.872 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.03 -44.57 0.06 Allowed 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.558 1.143 . . . . 10.0 109.688 166.804 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 6.9 tmtt? . . . . . 0 C--O 1.253 1.252 1 C-N-CA 133.144 4.578 . . . . 10.0 100.516 -177.072 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . 2.343 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.943 0 N-CA-C 112.206 0.447 . . . . 10.0 112.206 . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . 2.339 . . -80.22 179.83 7.46 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 127.047 2.139 . . . . 10.0 111.61 -170.288 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . -119.04 56.32 0.91 Allowed 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 123.423 0.689 . . . . 10.0 112.286 -179.212 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -102.41 175.88 2.09 Favored Pre-proline 0 N--CA 1.464 0.235 0 N-CA-C 104.3 -2.481 . . . . 10.0 104.3 105.941 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_endo -76.72 45.92 1.76 Allowed 'Trans proline' 0 CA--C 1.543 0.937 0 CA-C-N 122.531 1.94 . . . . 10.0 112.253 -173.504 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -84.28 146.67 27.64 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-O 121.874 0.845 . . . . 10.0 112.052 179.254 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 3.9 m -95.69 157.74 15.76 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 115.697 -0.683 . . . . 10.0 110.657 179.167 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -39.25 -38.06 0.48 Allowed 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 130.188 3.395 . . . . 10.0 113.135 177.05 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -58.63 -60.96 3.0 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 109.146 -0.687 . . . . 10.0 109.146 174.579 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 10' ' ' GLU . . . . . 0.401 ' OE2' ' NZ ' ' A' ' 89' ' ' LYS . 4.4 tp10 -56.94 -43.03 81.08 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.319 1.047 . . . . 10.0 110.744 176.907 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -46.03 -36.34 5.58 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 124.09 0.956 . . . . 10.0 111.275 172.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 19.6 m -74.71 -35.62 62.7 Favored 'General case' 0 N--CA 1.453 -0.311 0 O-C-N 121.08 -1.013 . . . . 10.0 108.937 -176.237 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 74.0 mt -70.55 -48.64 57.86 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.755 0 C-N-CA 124.251 1.02 . . . . 10.0 108.581 -174.427 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -57.05 -38.81 73.76 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 120.245 -0.582 . . . . 10.0 111.263 175.277 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 83.5 m -61.52 -49.53 76.35 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 122.712 0.405 . . . . 10.0 110.302 176.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 52.9 t -56.68 -55.39 19.9 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 O-C-N 121.431 -0.793 . . . . 10.0 110.367 176.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 30.5 m -60.29 -41.05 85.69 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 C-N-CA 120.096 -0.641 . . . . 10.0 111.522 -175.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 12.6 m -50.63 -52.16 42.16 Favored 'General case' 0 N--CA 1.457 -0.1 0 C-N-CA 123.872 0.869 . . . . 10.0 110.258 169.852 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 56.4 m -67.04 -19.82 65.74 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 112.767 0.655 . . . . 10.0 112.767 -169.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 67.5 m-85 -56.85 -41.81 78.58 Favored 'General case' 0 N--CA 1.466 0.354 0 O-C-N 120.685 -1.26 . . . . 10.0 110.838 164.247 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -71.27 -53.41 14.41 Favored 'General case' 0 C--O 1.232 0.154 0 N-CA-C 108.121 -1.066 . . . . 10.0 108.121 175.369 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 3.5 m -82.46 59.72 4.75 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 108.489 -0.93 . . . . 10.0 108.489 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 19.0 t80 -96.72 -73.39 0.6 Allowed 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 125.7 1.6 . . . . 10.0 107.741 -177.305 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -162.86 57.03 0.2 Allowed 'General case' 0 N--CA 1.455 -0.207 0 N-CA-C 109.03 -0.73 . . . . 10.0 109.03 173.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . 0.26 0.0 OUTLIER 58.33 120.16 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 127.383 2.273 . . . . 10.0 114.179 176.695 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . 2.415 0.1 OUTLIER -160.51 160.01 31.44 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 128.178 2.591 . . . . 10.0 106.159 162.265 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 48.5 mp0 -83.22 61.56 6.17 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 120.028 1.286 . . . . 10.0 109.781 -175.747 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . 91.97 116.7 2.21 Favored Glycine 0 CA--C 1.525 0.673 0 N-CA-C 110.259 -1.136 . . . . 10.0 110.259 -176.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.83 170.5 14.94 Favored 'General case' 0 C--O 1.236 0.368 0 O-C-N 122.408 -0.466 . . . . 10.0 110.862 -177.939 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 57.4 mtpt -82.82 -99.74 0.04 OUTLIER 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 108.484 -0.932 . . . . 10.0 108.484 169.358 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -125.02 -51.38 1.67 Allowed 'General case' 0 CA--C 1.528 0.124 0 C-N-CA 123.526 0.73 . . . . 10.0 110.874 -169.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 23.7 t -154.38 -161.86 1.3 Allowed 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 106.843 -1.54 . . . . 10.0 106.843 168.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -91.28 -165.05 1.27 Allowed 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 125.068 1.347 . . . . 10.0 108.77 -177.595 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 3.2 m -77.39 159.46 29.46 Favored 'General case' 0 N--CA 1.465 0.295 0 O-C-N 121.444 -0.785 . . . . 10.0 109.248 165.11 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 1.4 t -61.56 -57.45 12.07 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 O-C-N 121.405 -0.809 . . . . 10.0 111.957 -173.037 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -56.16 -53.47 56.71 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 108.539 -0.911 . . . . 10.0 108.539 -176.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 65.6 tt0 -45.62 -60.29 2.28 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 126.214 1.806 . . . . 10.0 109.54 176.403 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 6.1 t80 -42.73 -54.28 4.14 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 124.568 1.147 . . . . 10.0 110.482 174.683 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . 0.27 0.7 OUTLIER -55.86 -44.86 78.45 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 118.147 0.43 . . . . 10.0 111.308 -178.429 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -68.34 -44.85 74.38 Favored 'General case' 0 CA--C 1.527 0.086 0 O-C-N 121.302 -0.874 . . . . 10.0 110.991 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -55.64 -52.36 64.08 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 122.696 0.398 . . . . 10.0 110.312 177.173 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 34.4 m -58.9 -43.08 87.69 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 CA-C-N 119.603 1.092 . . . . 10.0 111.134 177.61 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 46.8 m -52.19 -48.2 65.16 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 118.652 0.66 . . . . 10.0 110.534 174.74 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 50.1 mt-30 -61.86 -46.22 90.36 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 122.984 0.514 . . . . 10.0 111.101 178.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -65.24 -30.05 70.89 Favored 'General case' 0 CA--C 1.528 0.128 0 C-N-CA 123.732 0.813 . . . . 10.0 111.995 -179.011 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 6.0 mp -105.75 71.57 0.24 Allowed Pre-proline 0 CA--C 1.539 0.519 0 C-N-CA 123.896 0.878 . . . . 10.0 110.542 178.301 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_endo -71.44 -10.0 26.16 Favored 'Trans proline' 0 CA--C 1.537 0.66 0 C-N-CA 122.151 1.901 . . . . 10.0 111.681 173.086 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -38.34 -62.72 0.56 Allowed 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 127.248 2.219 . . . . 10.0 112.751 -170.71 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 49.6 tp -141.75 -60.45 0.47 Allowed 'General case' 0 C--O 1.232 0.15 0 CA-C-O 118.602 -0.713 . . . . 10.0 109.814 -175.332 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 31.2 mt 64.97 57.46 0.98 Allowed 'General case' 0 C--N 1.339 0.149 0 C-N-CA 126.442 1.897 . . . . 10.0 109.541 -178.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.26 -36.06 30.38 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 115.367 -0.833 . . . . 10.0 110.997 176.496 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 28.67 89.55 0.01 OUTLIER 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 131.646 3.978 . . . . 10.0 115.445 167.502 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 13.6 p -140.96 163.04 22.06 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.516 0 N-CA-C 106.323 -1.732 . . . . 10.0 106.323 169.728 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 85.11 -114.05 3.9 Favored Glycine 0 CA--C 1.522 0.523 0 N-CA-C 107.159 -2.376 . . . . 10.0 107.159 -167.12 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 55' ' ' SER . . . . . . . . . . . . 0.357 58.8 m -58.72 -14.01 7.47 Favored 'General case' 0 CA--C 1.517 -0.311 0 N-CA-C 115.665 1.728 . . . . 10.0 115.665 -176.223 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -38.14 -51.89 1.43 Allowed 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 118.679 0.672 . . . . 10.0 109.289 160.409 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -66.17 -63.79 1.0 Allowed 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 118.746 -0.645 . . . . 10.0 111.637 -177.497 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -40.66 -50.44 3.05 Favored 'General case' 0 C--N 1.347 0.492 0 CA-C-N 118.954 0.797 . . . . 10.0 111.484 176.043 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 59' ' ' LYS . . . . . 0.403 ' NZ ' ' OE1' ' B' ' 86' ' ' GLU . 2.9 ttpm? -71.17 -47.31 58.43 Favored 'General case' 0 N--CA 1.443 -0.782 0 CA-C-N 116.002 -0.545 . . . . 10.0 109.79 -173.902 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 28.0 ttt -50.66 -55.37 16.79 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 118.386 0.539 . . . . 10.0 110.007 178.052 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.0 -42.96 94.01 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 118.998 -1.081 . . . . 10.0 110.857 179.74 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 23.3 t -51.76 -45.25 63.64 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 118.144 0.429 . . . . 10.0 111.645 177.557 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.23 -61.2 2.62 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 108.184 -1.043 . . . . 10.0 108.184 172.184 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -39.8 -46.65 1.98 Allowed 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 125.174 1.389 . . . . 10.0 113.285 -170.331 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 39.2 t -37.96 -59.37 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 C-N-CA 125.643 1.577 . . . . 10.0 111.996 -177.376 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 48.0 m-80 -149.01 58.41 1.04 Allowed 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.382 0.61 . . . . 10.0 109.467 176.028 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -62.67 -28.42 69.92 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 113.641 0.978 . . . . 10.0 113.641 -168.496 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -49.85 -41.73 45.86 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 124.312 1.045 . . . . 10.0 111.996 171.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 7.4 t -62.06 158.36 16.77 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 121.544 0.687 . . . . 10.0 112.453 -163.658 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 74.3 mt-10 -63.09 127.75 32.67 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.617 -0.72 . . . . 10.0 109.854 171.665 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 16.0 tp -90.25 152.64 20.97 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 124.9 1.28 . . . . 10.0 108.088 172.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 6.9 mptt -121.35 166.61 13.82 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 123.692 0.797 . . . . 10.0 109.652 174.336 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 44.5 p90 -58.44 -38.62 77.85 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 115.8 -0.636 . . . . 10.0 111.394 -170.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -47.74 -60.95 2.19 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.573 1.149 . . . . 10.0 111.59 172.186 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -63.28 -51.67 65.13 Favored 'General case' 0 N--CA 1.455 -0.203 0 O-C-N 121.996 -0.44 . . . . 10.0 110.343 -177.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -41.57 -48.24 3.95 Favored 'General case' 0 C--N 1.341 0.203 0 O-C-N 124.268 0.98 . . . . 10.0 109.64 177.315 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 77' ' ' TRP . . . . . . . . . . . . . 1.3 t-105 -54.99 -66.83 0.34 Allowed 'General case' 0 N--CA 1.442 -0.828 0 O-C-N 123.207 0.317 . . . . 10.0 110.855 -174.062 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 70.2 mtm180 -39.41 -52.42 2.07 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.006 0.922 . . . . 10.0 110.219 172.135 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -59.1 -44.08 91.92 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 112.8 0.667 . . . . 10.0 112.8 -177.011 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 3.0 pt -69.73 -30.96 46.77 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 CA-C-N 120.715 1.598 . . . . 10.0 110.493 174.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -54.4 -53.44 38.28 Favored Glycine 0 CA--C 1.525 0.7 0 N-CA-C 111.034 -0.827 . . . . 10.0 111.034 171.299 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -55.08 -44.78 75.16 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 125.62 1.568 . . . . 10.0 109.944 172.367 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -55.28 -49.2 72.71 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 121.222 -0.924 . . . . 10.0 110.834 174.118 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -56.81 -41.67 78.18 Favored 'General case' 0 CA--C 1.541 0.598 0 O-C-N 120.318 -1.488 . . . . 10.0 112.16 171.419 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 24.5 tttt -55.93 -41.69 75.0 Favored 'General case' 0 CA--C 1.536 0.421 0 O-C-N 121.34 -0.85 . . . . 10.0 110.54 177.323 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . 0.403 ' OE1' ' NZ ' ' B' ' 59' ' ' LYS . 19.6 mt-10 -69.07 -75.84 0.1 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 128.106 2.562 . . . . 10.0 110.413 176.29 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -81.56 85.35 1.6 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.375 0 N-CA-C 107.748 -1.205 . . . . 10.0 107.748 -178.584 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 51.3 mtp85 -80.87 66.7 6.49 Favored 'General case' 0 CA--C 1.531 0.227 0 N-CA-C 109.258 -0.645 . . . . 10.0 109.258 -173.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -46.64 -53.48 11.49 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 124.939 1.296 . . . . 10.0 111.967 -174.544 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 63.84 -70.63 0.07 Allowed 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 126.113 1.765 . . . . 10.0 114.208 162.701 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 39.2 tttm -118.57 -61.82 1.61 Allowed 'General case' 0 N--CA 1.456 -0.149 0 C-N-CA 125.476 1.51 . . . . 10.0 109.177 -174.605 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 43.8 m-20 -90.96 57.13 3.4 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-O 122.149 0.976 . . . . 10.0 108.404 -163.107 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 8.3 tt -81.24 -62.16 1.74 Allowed 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 114.178 -1.373 . . . . 10.0 109.03 -168.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 35.7 mttm -74.81 -19.59 60.13 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 115.457 -0.792 . . . . 10.0 110.705 -179.104 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . . 1.9 mp -58.45 -18.9 12.84 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 C-N-CA 124.723 1.209 . . . . 10.0 110.928 167.161 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 70.6 ttt180 76.4 -85.8 0.02 OUTLIER 'General case' 0 C--N 1.341 0.228 0 C-N-CA 123.724 0.81 . . . . 10.0 110.126 167.41 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 22.2 tttp 170.41 -62.15 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 104.762 -2.31 . . . . 10.0 104.762 -164.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.001 0 C-N-CA 130.073 3.349 . . . . 10.0 103.812 153.256 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.8 mtt . . . . . 0 N--CA 1.473 0.713 0 N-CA-C 107.266 -1.383 . . . . 10.0 107.266 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -155.7 144.54 20.51 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 107.218 -1.401 . . . . 10.0 107.218 176.122 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -157.43 54.29 0.49 Allowed 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 109.551 -0.537 . . . . 10.0 109.551 165.479 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 25.2 pm0 -126.97 152.8 76.08 Favored Pre-proline 0 N--CA 1.45 -0.453 0 C-N-CA 125.118 1.367 . . . . 10.0 109.418 -179.299 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_endo -75.66 67.29 6.49 Favored 'Trans proline' 0 N--CA 1.449 -1.134 0 C-N-CA 122.718 2.279 . . . . 10.0 109.472 173.038 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.3 pp -78.58 156.69 29.02 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 109.031 -0.729 . . . . 10.0 109.031 171.531 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 8.4 m -135.89 158.36 44.58 Favored 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 105.428 -2.064 . . . . 10.0 105.428 174.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -44.07 -43.61 6.96 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.743 1.617 . . . . 10.0 112.933 -172.199 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -59.19 -53.86 53.51 Favored 'General case' 0 CA--C 1.534 0.352 0 O-C-N 121.629 -0.669 . . . . 10.0 109.576 177.502 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.61 -47.15 77.01 Favored 'General case' 0 C--O 1.227 -0.09 0 N-CA-C 108.723 -0.843 . . . . 10.0 108.723 178.936 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 19.5 tt0 -56.56 -41.08 76.27 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 124.361 1.064 . . . . 10.0 110.709 179.59 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 40.1 m -63.82 -44.2 93.95 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 108.349 -0.982 . . . . 10.0 108.349 -179.369 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 43.9 mt -66.97 -49.0 77.87 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 CA-C-N 115.451 -0.795 . . . . 10.0 110.329 -176.474 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.51 ' HB2' HD11 ' B' ' 93' ' ' LEU . 0.0 OUTLIER -58.59 -41.05 84.88 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 117.94 0.336 . . . . 10.0 110.185 178.54 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 91.4 m -56.09 -55.0 38.31 Favored 'General case' 0 CA--C 1.53 0.173 0 CA-C-O 119.301 -0.381 . . . . 10.0 110.24 173.176 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 55.8 t -53.72 -56.41 9.05 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.28 0 CA-C-N 119.463 1.029 . . . . 10.0 110.49 179.693 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.402 HG22 ' HA ' ' A' ' 14' ' ' GLU . 33.3 m -59.93 -43.95 93.4 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 C-N-CA 120.144 -0.622 . . . . 10.0 111.281 -174.252 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -64.27 -36.64 84.76 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 109.929 -0.397 . . . . 10.0 109.929 178.686 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 99.5 m -62.45 -27.12 68.89 Favored 'General case' 0 CA--C 1.534 0.332 0 O-C-N 121.653 -0.654 . . . . 10.0 112.216 -178.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 52.5 m-85 -56.65 -37.59 70.99 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 120.314 1.415 . . . . 10.0 111.054 168.664 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -72.78 -57.82 3.8 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.935 0.894 . . . . 10.0 108.637 174.89 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 4.4 m -82.96 59.43 4.89 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 108.182 -1.044 . . . . 10.0 108.182 179.734 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 23.2 t80 -84.07 -57.6 3.12 Favored 'General case' 0 N--CA 1.454 -0.228 0 N-CA-C 107.958 -1.127 . . . . 10.0 107.958 -174.282 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -159.69 57.67 0.38 Allowed 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 107.132 -1.432 . . . . 10.0 107.132 164.008 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 5.7 tmm_? 58.44 93.06 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.799 1.24 . . . . 10.0 108.749 -168.276 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -137.52 98.36 3.68 Favored 'General case' 0 N--CA 1.455 -0.209 0 O-C-N 121.601 -0.687 . . . . 10.0 111.677 -171.867 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 11.8 mp0 -81.82 158.56 24.04 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 125.08 1.352 . . . . 10.0 107.849 173.196 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 56.26 38.18 76.71 Favored Glycine 0 CA--C 1.53 1.017 0 N-CA-C 112.142 -0.383 . . . . 10.0 112.142 -179.509 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.36 133.16 35.38 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 106.597 -1.631 . . . . 10.0 106.597 178.007 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 44.7 mtmt -81.69 -108.85 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 107.603 -1.258 . . . . 10.0 107.603 -179.255 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -97.5 -124.08 0.14 Allowed 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 106.807 -1.553 . . . . 10.0 106.807 169.675 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 20.1 t -82.22 -162.43 0.56 Allowed 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.194 0.998 . . . . 10.0 109.802 172.311 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -94.53 -161.19 0.83 Allowed 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 125.263 1.425 . . . . 10.0 108.958 -172.792 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -86.97 165.19 16.05 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 109.296 -0.631 . . . . 10.0 109.296 170.214 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.428 HG12 ' HG ' ' A' ' 63' ' ' LEU . 56.0 t -73.11 -54.14 16.52 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 O-C-N 121.289 -0.882 . . . . 10.0 112.477 -168.699 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -62.86 -47.01 85.21 Favored 'General case' 0 N--CA 1.468 0.46 0 O-C-N 120.938 -1.101 . . . . 10.0 109.107 179.073 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 69.2 tt0 -43.8 -58.91 2.48 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 125.89 1.676 . . . . 10.0 109.77 173.844 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 9.5 t80 -44.93 -54.03 6.95 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.946 0.899 . . . . 10.0 111.663 171.944 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 3.4 tmtt? -54.78 -42.49 71.79 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 118.302 0.501 . . . . 10.0 111.52 179.371 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 -70.92 -35.27 72.19 Favored 'General case' 0 CA--C 1.532 0.287 0 O-C-N 121.724 -0.61 . . . . 10.0 111.955 178.539 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 51.0 mt -63.86 -55.08 25.51 Favored 'General case' 0 N--CA 1.453 -0.29 0 O-C-N 121.768 -0.582 . . . . 10.0 110.205 175.292 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 35.1 m -56.19 -45.54 80.98 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 O-C-N 120.686 -1.259 . . . . 10.0 111.864 -174.423 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 15.0 t -60.58 -22.94 64.26 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 119.285 0.948 . . . . 10.0 112.744 177.528 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -80.15 -53.63 6.51 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 108.732 -0.84 . . . . 10.0 108.732 175.863 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.27 -32.76 71.47 Favored 'General case' 0 C--O 1.233 0.188 0 C-N-CA 124.399 1.08 . . . . 10.0 111.7 -175.874 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 6.4 mp -95.48 85.56 0.29 Allowed Pre-proline 0 CA--C 1.535 0.391 0 C-N-CA 125.339 1.455 . . . . 10.0 109.039 172.753 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -71.08 -13.13 31.17 Favored 'Trans proline' 0 N--CA 1.458 -0.612 0 C-N-CA 121.671 1.581 . . . . 10.0 112.506 175.082 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 55.9 t60 -54.43 -57.3 11.84 Favored 'General case' 0 CA--C 1.532 0.261 0 N-CA-C 114.087 1.143 . . . . 10.0 114.087 -157.23 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.3 tt -152.23 -60.13 0.16 Allowed 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 118.954 0.797 . . . . 10.0 111.857 -174.201 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.5 mm? 67.57 62.43 0.43 Allowed 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 125.261 1.424 . . . . 10.0 109.955 -174.862 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.91 -33.83 33.89 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 124.124 0.969 . . . . 10.0 111.509 175.231 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . 0.255 1.4 m-20 28.41 93.23 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 130.976 3.711 . . . . 10.0 116.906 167.948 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 13.3 p -133.79 159.3 42.57 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.351 0 C-N-CA 123.204 0.602 . . . . 10.0 111.069 175.047 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 76.28 -98.85 1.26 Allowed Glycine 0 CA--C 1.522 0.517 0 N-CA-C 108.944 -1.662 . . . . 10.0 108.944 -174.955 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 22.8 m -63.06 -18.39 63.32 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 113.01 0.744 . . . . 10.0 113.01 -174.509 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.402 ' C ' HD13 ' A' ' 56' ' ' LEU . 3.0 tm? -41.54 -55.88 2.73 Favored 'General case' 0 N--CA 1.457 -0.088 0 CA-C-N 118.479 0.581 . . . . 10.0 109.444 165.314 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -63.23 -52.2 63.18 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 116.267 -0.424 . . . . 10.0 110.562 -175.537 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -45.45 -54.81 6.88 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 124.453 1.101 . . . . 10.0 111.061 175.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.407 ' NZ ' ' OE1' ' A' ' 86' ' ' GLU . 0.8 OUTLIER -65.32 -45.63 83.53 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 123.665 0.786 . . . . 10.0 109.162 -176.754 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 28.3 ttt -51.64 -52.6 46.54 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 118.659 -0.686 . . . . 10.0 109.816 178.072 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . 0.254 0.0 OUTLIER -63.47 -41.19 98.61 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 118.844 -1.143 . . . . 10.0 110.758 179.496 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 34.3 m -55.51 -42.66 74.8 Favored 'General case' 0 CA--C 1.532 0.265 0 O-C-N 121.847 -0.533 . . . . 10.0 111.226 179.583 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.428 ' HG ' HG12 ' A' ' 35' ' ' VAL . 0.0 OUTLIER -67.35 -50.84 58.23 Favored 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 109.265 -0.642 . . . . 10.0 109.265 174.425 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -47.03 -45.58 21.47 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.602 1.161 . . . . 10.0 112.869 -177.577 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 42.7 t -42.94 -69.08 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.384 0 C-N-CA 124.859 1.264 . . . . 10.0 112.319 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 58.8 m-80 -148.94 59.39 1.05 Allowed 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 122.912 0.485 . . . . 10.0 110.957 -178.655 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -57.45 -21.37 36.62 Favored 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 114.892 1.442 . . . . 10.0 114.892 178.623 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -51.92 -33.42 37.11 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 123.527 0.731 . . . . 10.0 110.738 172.557 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 16.5 m -50.78 148.0 4.4 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 121.914 0.864 . . . . 10.0 111.674 174.276 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 74.2 mt-10 -63.04 149.21 45.59 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 115.088 -0.96 . . . . 10.0 109.089 164.015 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 37.8 tp -94.13 157.62 15.99 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 106.793 -1.558 . . . . 10.0 106.793 162.866 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 45.9 mttp -137.65 152.08 48.96 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 118.49 0.586 . . . . 10.0 110.046 173.342 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 48.0 p90 -49.32 -42.96 43.07 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 124.465 1.106 . . . . 10.0 113.63 -163.071 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 17.5 p-10 -63.38 -37.88 88.99 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.201 0.601 . . . . 10.0 111.335 -179.832 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -78.45 -46.97 18.45 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 122.965 0.506 . . . . 10.0 109.761 -179.189 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -40.37 -50.31 2.83 Favored 'General case' 0 C--N 1.339 0.132 0 C-N-CA 124.06 0.944 . . . . 10.0 108.833 166.867 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' TRP . . . . . 0.409 ' NE1' HG13 ' B' ' 80' ' ' ILE . 0.6 OUTLIER -47.23 -70.33 0.1 Allowed 'General case' 0 N--CA 1.445 -0.724 0 C-N-CA 123.111 0.564 . . . . 10.0 111.63 178.587 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 65.5 mtm-85 -39.52 -51.49 2.18 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.256 0.622 . . . . 10.0 111.46 174.844 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 5.3 mp -61.29 -45.05 96.08 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-O 118.716 -0.659 . . . . 10.0 112.289 -176.367 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 2.5 pt -69.48 -28.6 38.62 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.358 0 CA-C-N 120.376 1.444 . . . . 10.0 110.299 175.627 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -54.25 -54.62 30.87 Favored Glycine 0 C--N 1.335 0.526 0 N-CA-C 110.319 -1.112 . . . . 10.0 110.319 170.636 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -53.53 -44.11 68.91 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 115.123 -0.538 . . . . 10.0 110.618 171.584 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 20.0 tp -57.23 -47.69 80.72 Favored 'General case' 0 CA--C 1.536 0.419 0 O-C-N 121.298 -0.876 . . . . 10.0 112.518 175.911 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -56.92 -47.44 80.6 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 120.492 1.496 . . . . 10.0 111.288 173.679 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 42.6 tttt -55.85 -33.33 64.42 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.618 1.567 . . . . 10.0 112.292 177.151 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.407 ' OE1' ' NZ ' ' A' ' 59' ' ' LYS . 23.0 mt-10 -74.62 -79.62 0.09 Allowed 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 127.337 2.255 . . . . 10.0 109.08 169.454 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.446 HG23 ' O ' ' A' ' 87' ' ' ILE . 0.2 OUTLIER -81.56 84.11 1.53 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.244 0 CA-C-O 122.8 1.286 . . . . 10.0 110.041 -173.556 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 49.2 mtt180 -81.16 105.87 12.7 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 115.198 -0.91 . . . . 10.0 108.595 179.104 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' LYS . . . . . 0.418 ' H ' ' CD ' ' A' ' 89' ' ' LYS . 0.3 OUTLIER -48.01 121.76 4.52 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 108.013 -1.106 . . . . 10.0 108.013 169.341 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 65.9 tttp -56.17 -44.99 79.87 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 117.825 0.284 . . . . 10.0 110.71 -174.601 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 46.7 tttm -167.67 -61.75 0.03 OUTLIER 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 107.902 -1.147 . . . . 10.0 107.902 170.205 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -114.04 62.8 0.66 Allowed 'General case' 0 C--O 1.225 -0.215 0 C-N-CA 124.186 0.994 . . . . 10.0 108.777 -165.602 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -46.2 -40.7 11.68 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 114.255 1.205 . . . . 10.0 114.255 -170.867 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 38.7 mttp -54.62 -21.02 9.26 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 113.394 0.887 . . . . 10.0 113.394 179.336 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 10.5 tt -56.64 -19.43 8.88 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 C-N-CA 123.702 0.801 . . . . 10.0 112.533 171.837 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 78.31 -60.05 0.41 Allowed 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 125.695 1.598 . . . . 10.0 109.148 -178.872 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.03 -44.57 0.06 Allowed 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.558 1.143 . . . . 10.0 109.688 166.804 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 6.9 tmtt? . . . . . 0 C--O 1.253 1.252 1 C-N-CA 133.144 4.578 . . . . 10.0 100.516 -177.072 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . 2.343 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.943 0 N-CA-C 112.206 0.447 . . . . 10.0 112.206 . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . 2.339 . . -80.22 179.83 7.46 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 127.047 2.139 . . . . 10.0 111.61 -170.288 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . -119.04 56.32 0.91 Allowed 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 123.423 0.689 . . . . 10.0 112.286 -179.212 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -102.41 175.88 2.09 Favored Pre-proline 0 N--CA 1.464 0.235 0 N-CA-C 104.3 -2.481 . . . . 10.0 104.3 105.941 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_endo -76.72 45.92 1.76 Allowed 'Trans proline' 0 CA--C 1.543 0.937 0 CA-C-N 122.531 1.94 . . . . 10.0 112.253 -173.504 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -84.28 146.67 27.64 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-O 121.874 0.845 . . . . 10.0 112.052 179.254 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 3.9 m -95.69 157.74 15.76 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 115.697 -0.683 . . . . 10.0 110.657 179.167 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 8' ' ' GLU . . . . . 0.403 ' H ' ' CD ' ' B' ' 8' ' ' GLU . 1.3 mp0 -39.25 -38.06 0.48 Allowed 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 130.188 3.395 . . . . 10.0 113.135 177.05 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -58.63 -60.96 3.0 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 109.146 -0.687 . . . . 10.0 109.146 174.579 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 10' ' ' GLU . . . . . 0.401 ' OE2' ' NZ ' ' A' ' 89' ' ' LYS . 4.4 tp10 -56.94 -43.03 81.08 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.319 1.047 . . . . 10.0 110.744 176.907 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -46.03 -36.34 5.58 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 124.09 0.956 . . . . 10.0 111.275 172.826 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 19.6 m -74.71 -35.62 62.7 Favored 'General case' 0 N--CA 1.453 -0.311 0 O-C-N 121.08 -1.013 . . . . 10.0 108.937 -176.237 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 74.0 mt -70.55 -48.64 57.86 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.755 0 C-N-CA 124.251 1.02 . . . . 10.0 108.581 -174.427 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 14' ' ' GLU . . . . . 0.418 ' HA ' HG22 ' B' ' 17' ' ' VAL . 4.1 pt-20 -57.05 -38.81 73.76 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 120.245 -0.582 . . . . 10.0 111.263 175.277 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 83.5 m -61.52 -49.53 76.35 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 122.712 0.405 . . . . 10.0 110.302 176.825 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 52.9 t -56.68 -55.39 19.9 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 O-C-N 121.431 -0.793 . . . . 10.0 110.367 176.88 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.418 HG22 ' HA ' ' B' ' 14' ' ' GLU . 30.5 m -60.29 -41.05 85.69 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 C-N-CA 120.096 -0.641 . . . . 10.0 111.522 -175.647 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 12.6 m -50.63 -52.16 42.16 Favored 'General case' 0 N--CA 1.457 -0.1 0 C-N-CA 123.872 0.869 . . . . 10.0 110.258 169.852 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 56.4 m -67.04 -19.82 65.74 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 112.767 0.655 . . . . 10.0 112.767 -169.0 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 67.5 m-85 -56.85 -41.81 78.58 Favored 'General case' 0 N--CA 1.466 0.354 0 O-C-N 120.685 -1.26 . . . . 10.0 110.838 164.247 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -71.27 -53.41 14.41 Favored 'General case' 0 C--O 1.232 0.154 0 N-CA-C 108.121 -1.066 . . . . 10.0 108.121 175.369 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 3.5 m -82.46 59.72 4.75 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 108.489 -0.93 . . . . 10.0 108.489 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 19.0 t80 -96.72 -73.39 0.6 Allowed 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 125.7 1.6 . . . . 10.0 107.741 -177.305 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -162.86 57.03 0.2 Allowed 'General case' 0 N--CA 1.455 -0.207 0 N-CA-C 109.03 -0.73 . . . . 10.0 109.03 173.918 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . 0.26 0.0 OUTLIER 58.33 120.16 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 127.383 2.273 . . . . 10.0 114.179 176.695 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . 2.415 0.1 OUTLIER -160.51 160.01 31.44 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 128.178 2.591 . . . . 10.0 106.159 162.265 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 48.5 mp0 -83.22 61.56 6.17 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 120.028 1.286 . . . . 10.0 109.781 -175.747 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . 91.97 116.7 2.21 Favored Glycine 0 CA--C 1.525 0.673 0 N-CA-C 110.259 -1.136 . . . . 10.0 110.259 -176.846 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.83 170.5 14.94 Favored 'General case' 0 C--O 1.236 0.368 0 O-C-N 122.408 -0.466 . . . . 10.0 110.862 -177.939 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 57.4 mtpt -82.82 -99.74 0.04 OUTLIER 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 108.484 -0.932 . . . . 10.0 108.484 169.358 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -125.02 -51.38 1.67 Allowed 'General case' 0 CA--C 1.528 0.124 0 C-N-CA 123.526 0.73 . . . . 10.0 110.874 -169.856 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 23.7 t -154.38 -161.86 1.3 Allowed 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 106.843 -1.54 . . . . 10.0 106.843 168.882 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 33' ' ' LEU . . . . . 0.41 HD22 ' H ' ' B' ' 33' ' ' LEU . 1.0 OUTLIER -91.28 -165.05 1.27 Allowed 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 125.068 1.347 . . . . 10.0 108.77 -177.595 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 3.2 m -77.39 159.46 29.46 Favored 'General case' 0 N--CA 1.465 0.295 0 O-C-N 121.444 -0.785 . . . . 10.0 109.248 165.11 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 35' ' ' VAL . . . . . 0.534 HG13 HD13 ' B' ' 71' ' ' LEU . 1.4 t -61.56 -57.45 12.07 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 O-C-N 121.405 -0.809 . . . . 10.0 111.957 -173.037 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -56.16 -53.47 56.71 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 108.539 -0.911 . . . . 10.0 108.539 -176.892 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 65.6 tt0 -45.62 -60.29 2.28 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 126.214 1.806 . . . . 10.0 109.54 176.403 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 6.1 t80 -42.73 -54.28 4.14 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 124.568 1.147 . . . . 10.0 110.482 174.683 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . 0.27 0.7 OUTLIER -55.86 -44.86 78.45 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 118.147 0.43 . . . . 10.0 111.308 -178.429 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -68.34 -44.85 74.38 Favored 'General case' 0 CA--C 1.527 0.086 0 O-C-N 121.302 -0.874 . . . . 10.0 110.991 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -55.64 -52.36 64.08 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 122.696 0.398 . . . . 10.0 110.312 177.173 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 34.4 m -58.9 -43.08 87.69 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 CA-C-N 119.603 1.092 . . . . 10.0 111.134 177.61 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 46.8 m -52.19 -48.2 65.16 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 118.652 0.66 . . . . 10.0 110.534 174.74 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 50.1 mt-30 -61.86 -46.22 90.36 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 122.984 0.514 . . . . 10.0 111.101 178.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -65.24 -30.05 70.89 Favored 'General case' 0 CA--C 1.528 0.128 0 C-N-CA 123.732 0.813 . . . . 10.0 111.995 -179.011 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 6.0 mp -105.75 71.57 0.24 Allowed Pre-proline 0 CA--C 1.539 0.519 0 C-N-CA 123.896 0.878 . . . . 10.0 110.542 178.301 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_endo -71.44 -10.0 26.16 Favored 'Trans proline' 0 CA--C 1.537 0.66 0 C-N-CA 122.151 1.901 . . . . 10.0 111.681 173.086 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -38.34 -62.72 0.56 Allowed 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 127.248 2.219 . . . . 10.0 112.751 -170.71 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 49.6 tp -141.75 -60.45 0.47 Allowed 'General case' 0 C--O 1.232 0.15 0 CA-C-O 118.602 -0.713 . . . . 10.0 109.814 -175.332 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 31.2 mt 64.97 57.46 0.98 Allowed 'General case' 0 C--N 1.339 0.149 0 C-N-CA 126.442 1.897 . . . . 10.0 109.541 -178.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.26 -36.06 30.38 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 115.367 -0.833 . . . . 10.0 110.997 176.496 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 28.67 89.55 0.01 OUTLIER 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 131.646 3.978 . . . . 10.0 115.445 167.502 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 13.6 p -140.96 163.04 22.06 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.516 0 N-CA-C 106.323 -1.732 . . . . 10.0 106.323 169.728 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 85.11 -114.05 3.9 Favored Glycine 0 CA--C 1.522 0.523 0 N-CA-C 107.159 -2.376 . . . . 10.0 107.159 -167.12 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 55' ' ' SER . . . . . . . . . . . . 0.357 58.8 m -58.72 -14.01 7.47 Favored 'General case' 0 CA--C 1.517 -0.311 0 N-CA-C 115.665 1.728 . . . . 10.0 115.665 -176.223 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.449 HD13 ' C ' ' B' ' 56' ' ' LEU . 2.8 tm? -38.14 -51.89 1.43 Allowed 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 118.679 0.672 . . . . 10.0 109.289 160.409 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -66.17 -63.79 1.0 Allowed 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 118.746 -0.645 . . . . 10.0 111.637 -177.497 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -40.66 -50.44 3.05 Favored 'General case' 0 C--N 1.347 0.492 0 CA-C-N 118.954 0.797 . . . . 10.0 111.484 176.043 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 59' ' ' LYS . . . . . 0.403 ' NZ ' ' OE1' ' B' ' 86' ' ' GLU . 2.9 ttpm? -71.17 -47.31 58.43 Favored 'General case' 0 N--CA 1.443 -0.782 0 CA-C-N 116.002 -0.545 . . . . 10.0 109.79 -173.902 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 28.0 ttt -50.66 -55.37 16.79 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 118.386 0.539 . . . . 10.0 110.007 178.052 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.0 -42.96 94.01 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 118.998 -1.081 . . . . 10.0 110.857 179.74 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 23.3 t -51.76 -45.25 63.64 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 118.144 0.429 . . . . 10.0 111.645 177.557 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.23 -61.2 2.62 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 108.184 -1.043 . . . . 10.0 108.184 172.184 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -39.8 -46.65 1.98 Allowed 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 125.174 1.389 . . . . 10.0 113.285 -170.331 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 39.2 t -37.96 -59.37 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 C-N-CA 125.643 1.577 . . . . 10.0 111.996 -177.376 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 48.0 m-80 -149.01 58.41 1.04 Allowed 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.382 0.61 . . . . 10.0 109.467 176.028 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -62.67 -28.42 69.92 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 113.641 0.978 . . . . 10.0 113.641 -168.496 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -49.85 -41.73 45.86 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 124.312 1.045 . . . . 10.0 111.996 171.713 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 7.4 t -62.06 158.36 16.77 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 121.544 0.687 . . . . 10.0 112.453 -163.658 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 74.3 mt-10 -63.09 127.75 32.67 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.617 -0.72 . . . . 10.0 109.854 171.665 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 71' ' ' LEU . . . . . 0.534 HD13 HG13 ' B' ' 35' ' ' VAL . 16.0 tp -90.25 152.64 20.97 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 124.9 1.28 . . . . 10.0 108.088 172.709 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 6.9 mptt -121.35 166.61 13.82 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 123.692 0.797 . . . . 10.0 109.652 174.336 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 44.5 p90 -58.44 -38.62 77.85 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 115.8 -0.636 . . . . 10.0 111.394 -170.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -47.74 -60.95 2.19 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.573 1.149 . . . . 10.0 111.59 172.186 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -63.28 -51.67 65.13 Favored 'General case' 0 N--CA 1.455 -0.203 0 O-C-N 121.996 -0.44 . . . . 10.0 110.343 -177.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -41.57 -48.24 3.95 Favored 'General case' 0 C--N 1.341 0.203 0 O-C-N 124.268 0.98 . . . . 10.0 109.64 177.315 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 77' ' ' TRP . . . . . . . . . . . . . 1.3 t-105 -54.99 -66.83 0.34 Allowed 'General case' 0 N--CA 1.442 -0.828 0 O-C-N 123.207 0.317 . . . . 10.0 110.855 -174.062 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 70.2 mtm180 -39.41 -52.42 2.07 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.006 0.922 . . . . 10.0 110.219 172.135 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -59.1 -44.08 91.92 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 112.8 0.667 . . . . 10.0 112.8 -177.011 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 80' ' ' ILE . . . . . 0.409 HG13 ' NE1' ' A' ' 77' ' ' TRP . 3.0 pt -69.73 -30.96 46.77 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 CA-C-N 120.715 1.598 . . . . 10.0 110.493 174.95 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -54.4 -53.44 38.28 Favored Glycine 0 CA--C 1.525 0.7 0 N-CA-C 111.034 -0.827 . . . . 10.0 111.034 171.299 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -55.08 -44.78 75.16 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 125.62 1.568 . . . . 10.0 109.944 172.367 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -55.28 -49.2 72.71 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 121.222 -0.924 . . . . 10.0 110.834 174.118 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -56.81 -41.67 78.18 Favored 'General case' 0 CA--C 1.541 0.598 0 O-C-N 120.318 -1.488 . . . . 10.0 112.16 171.419 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 24.5 tttt -55.93 -41.69 75.0 Favored 'General case' 0 CA--C 1.536 0.421 0 O-C-N 121.34 -0.85 . . . . 10.0 110.54 177.323 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 86' ' ' GLU . . . . . 0.403 ' OE1' ' NZ ' ' B' ' 59' ' ' LYS . 19.6 mt-10 -69.07 -75.84 0.1 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 128.106 2.562 . . . . 10.0 110.413 176.29 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 87' ' ' ILE . . . . . 0.42 ' O ' HG23 ' B' ' 87' ' ' ILE . 0.2 OUTLIER -81.56 85.35 1.6 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.375 0 N-CA-C 107.748 -1.205 . . . . 10.0 107.748 -178.584 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 51.3 mtp85 -80.87 66.7 6.49 Favored 'General case' 0 CA--C 1.531 0.227 0 N-CA-C 109.258 -0.645 . . . . 10.0 109.258 -173.962 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -46.64 -53.48 11.49 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 124.939 1.296 . . . . 10.0 111.967 -174.544 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 63.84 -70.63 0.07 Allowed 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 126.113 1.765 . . . . 10.0 114.208 162.701 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 91' ' ' LYS . . . . . 0.4 ' NZ ' ' OD1' ' B' ' 92' ' ' ASP . 39.2 tttm -118.57 -61.82 1.61 Allowed 'General case' 0 N--CA 1.456 -0.149 0 C-N-CA 125.476 1.51 . . . . 10.0 109.177 -174.605 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 92' ' ' ASP . . . . . 0.4 ' OD1' ' NZ ' ' B' ' 91' ' ' LYS . 43.8 m-20 -90.96 57.13 3.4 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-O 122.149 0.976 . . . . 10.0 108.404 -163.107 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 93' ' ' LEU . . . . . 0.51 HD11 ' HB2' ' A' ' 14' ' ' GLU . 8.3 tt -81.24 -62.16 1.74 Allowed 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 114.178 -1.373 . . . . 10.0 109.03 -168.765 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 35.7 mttm -74.81 -19.59 60.13 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 115.457 -0.792 . . . . 10.0 110.705 -179.104 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . . 1.9 mp -58.45 -18.9 12.84 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 C-N-CA 124.723 1.209 . . . . 10.0 110.928 167.161 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 70.6 ttt180 76.4 -85.8 0.02 OUTLIER 'General case' 0 C--N 1.341 0.228 0 C-N-CA 123.724 0.81 . . . . 10.0 110.126 167.41 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 22.2 tttp 170.41 -62.15 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 104.762 -2.31 . . . . 10.0 104.762 -164.946 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.001 0 C-N-CA 130.073 3.349 . . . . 10.0 103.812 153.256 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.8 mtt . . . . . 0 N--CA 1.473 0.713 0 N-CA-C 107.266 -1.383 . . . . 10.0 107.266 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -155.7 144.54 20.51 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 107.218 -1.401 . . . . 10.0 107.218 176.122 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -157.43 54.29 0.49 Allowed 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 109.551 -0.537 . . . . 10.0 109.551 165.479 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 25.2 pm0 -126.97 152.8 76.08 Favored Pre-proline 0 N--CA 1.45 -0.453 0 C-N-CA 125.118 1.367 . . . . 10.0 109.418 -179.299 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_endo -75.66 67.29 6.49 Favored 'Trans proline' 0 N--CA 1.449 -1.134 0 C-N-CA 122.718 2.279 . . . . 10.0 109.472 173.038 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.3 pp -78.58 156.69 29.02 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 109.031 -0.729 . . . . 10.0 109.031 171.531 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 8.4 m -135.89 158.36 44.58 Favored 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 105.428 -2.064 . . . . 10.0 105.428 174.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -44.07 -43.61 6.96 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.743 1.617 . . . . 10.0 112.933 -172.199 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -59.19 -53.86 53.51 Favored 'General case' 0 CA--C 1.534 0.352 0 O-C-N 121.629 -0.669 . . . . 10.0 109.576 177.502 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.61 -47.15 77.01 Favored 'General case' 0 C--O 1.227 -0.09 0 N-CA-C 108.723 -0.843 . . . . 10.0 108.723 178.936 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 19.5 tt0 -56.56 -41.08 76.27 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 124.361 1.064 . . . . 10.0 110.709 179.59 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 40.1 m -63.82 -44.2 93.95 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 108.349 -0.982 . . . . 10.0 108.349 -179.369 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 43.9 mt -66.97 -49.0 77.87 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 CA-C-N 115.451 -0.795 . . . . 10.0 110.329 -176.474 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.51 ' HB2' HD11 ' B' ' 93' ' ' LEU . 0.0 OUTLIER -58.59 -41.05 84.88 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 117.94 0.336 . . . . 10.0 110.185 178.54 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 91.4 m -56.09 -55.0 38.31 Favored 'General case' 0 CA--C 1.53 0.173 0 CA-C-O 119.301 -0.381 . . . . 10.0 110.24 173.176 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 55.8 t -53.72 -56.41 9.05 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.28 0 CA-C-N 119.463 1.029 . . . . 10.0 110.49 179.693 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.402 HG22 ' HA ' ' A' ' 14' ' ' GLU . 33.3 m -59.93 -43.95 93.4 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 C-N-CA 120.144 -0.622 . . . . 10.0 111.281 -174.252 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -64.27 -36.64 84.76 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 109.929 -0.397 . . . . 10.0 109.929 178.686 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 99.5 m -62.45 -27.12 68.89 Favored 'General case' 0 CA--C 1.534 0.332 0 O-C-N 121.653 -0.654 . . . . 10.0 112.216 -178.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 52.5 m-85 -56.65 -37.59 70.99 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 120.314 1.415 . . . . 10.0 111.054 168.664 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -72.78 -57.82 3.8 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.935 0.894 . . . . 10.0 108.637 174.89 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 4.4 m -82.96 59.43 4.89 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 108.182 -1.044 . . . . 10.0 108.182 179.734 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 23.2 t80 -84.07 -57.6 3.12 Favored 'General case' 0 N--CA 1.454 -0.228 0 N-CA-C 107.958 -1.127 . . . . 10.0 107.958 -174.282 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -159.69 57.67 0.38 Allowed 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 107.132 -1.432 . . . . 10.0 107.132 164.008 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 5.7 tmm_? 58.44 93.06 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.799 1.24 . . . . 10.0 108.749 -168.276 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -137.52 98.36 3.68 Favored 'General case' 0 N--CA 1.455 -0.209 0 O-C-N 121.601 -0.687 . . . . 10.0 111.677 -171.867 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 11.8 mp0 -81.82 158.56 24.04 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 125.08 1.352 . . . . 10.0 107.849 173.196 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 56.26 38.18 76.71 Favored Glycine 0 CA--C 1.53 1.017 0 N-CA-C 112.142 -0.383 . . . . 10.0 112.142 -179.509 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.36 133.16 35.38 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 106.597 -1.631 . . . . 10.0 106.597 178.007 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 44.7 mtmt -81.69 -108.85 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 107.603 -1.258 . . . . 10.0 107.603 -179.255 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -97.5 -124.08 0.14 Allowed 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 106.807 -1.553 . . . . 10.0 106.807 169.675 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 20.1 t -82.22 -162.43 0.56 Allowed 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.194 0.998 . . . . 10.0 109.802 172.311 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -94.53 -161.19 0.83 Allowed 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 125.263 1.425 . . . . 10.0 108.958 -172.792 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -86.97 165.19 16.05 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 109.296 -0.631 . . . . 10.0 109.296 170.214 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.428 HG12 ' HG ' ' A' ' 63' ' ' LEU . 56.0 t -73.11 -54.14 16.52 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 O-C-N 121.289 -0.882 . . . . 10.0 112.477 -168.699 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -62.86 -47.01 85.21 Favored 'General case' 0 N--CA 1.468 0.46 0 O-C-N 120.938 -1.101 . . . . 10.0 109.107 179.073 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 69.2 tt0 -43.8 -58.91 2.48 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 125.89 1.676 . . . . 10.0 109.77 173.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 9.5 t80 -44.93 -54.03 6.95 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.946 0.899 . . . . 10.0 111.663 171.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 3.4 tmtt? -54.78 -42.49 71.79 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 118.302 0.501 . . . . 10.0 111.52 179.371 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 -70.92 -35.27 72.19 Favored 'General case' 0 CA--C 1.532 0.287 0 O-C-N 121.724 -0.61 . . . . 10.0 111.955 178.539 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 51.0 mt -63.86 -55.08 25.51 Favored 'General case' 0 N--CA 1.453 -0.29 0 O-C-N 121.768 -0.582 . . . . 10.0 110.205 175.292 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 35.1 m -56.19 -45.54 80.98 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 O-C-N 120.686 -1.259 . . . . 10.0 111.864 -174.423 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 15.0 t -60.58 -22.94 64.26 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 119.285 0.948 . . . . 10.0 112.744 177.528 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -80.15 -53.63 6.51 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 108.732 -0.84 . . . . 10.0 108.732 175.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.27 -32.76 71.47 Favored 'General case' 0 C--O 1.233 0.188 0 C-N-CA 124.399 1.08 . . . . 10.0 111.7 -175.874 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 6.4 mp -95.48 85.56 0.29 Allowed Pre-proline 0 CA--C 1.535 0.391 0 C-N-CA 125.339 1.455 . . . . 10.0 109.039 172.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -71.08 -13.13 31.17 Favored 'Trans proline' 0 N--CA 1.458 -0.612 0 C-N-CA 121.671 1.581 . . . . 10.0 112.506 175.082 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 55.9 t60 -54.43 -57.3 11.84 Favored 'General case' 0 CA--C 1.532 0.261 0 N-CA-C 114.087 1.143 . . . . 10.0 114.087 -157.23 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.3 tt -152.23 -60.13 0.16 Allowed 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 118.954 0.797 . . . . 10.0 111.857 -174.201 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.5 mm? 67.57 62.43 0.43 Allowed 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 125.261 1.424 . . . . 10.0 109.955 -174.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.91 -33.83 33.89 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 124.124 0.969 . . . . 10.0 111.509 175.231 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . 0.255 1.4 m-20 28.41 93.23 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 130.976 3.711 . . . . 10.0 116.906 167.948 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 13.3 p -133.79 159.3 42.57 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.351 0 C-N-CA 123.204 0.602 . . . . 10.0 111.069 175.047 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 76.28 -98.85 1.26 Allowed Glycine 0 CA--C 1.522 0.517 0 N-CA-C 108.944 -1.662 . . . . 10.0 108.944 -174.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 22.8 m -63.06 -18.39 63.32 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 113.01 0.744 . . . . 10.0 113.01 -174.509 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.402 ' C ' HD13 ' A' ' 56' ' ' LEU . 3.0 tm? -41.54 -55.88 2.73 Favored 'General case' 0 N--CA 1.457 -0.088 0 CA-C-N 118.479 0.581 . . . . 10.0 109.444 165.314 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -63.23 -52.2 63.18 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 116.267 -0.424 . . . . 10.0 110.562 -175.537 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -45.45 -54.81 6.88 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 124.453 1.101 . . . . 10.0 111.061 175.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.407 ' NZ ' ' OE1' ' A' ' 86' ' ' GLU . 0.8 OUTLIER -65.32 -45.63 83.53 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 123.665 0.786 . . . . 10.0 109.162 -176.754 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 28.3 ttt -51.64 -52.6 46.54 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 118.659 -0.686 . . . . 10.0 109.816 178.072 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . 0.254 0.0 OUTLIER -63.47 -41.19 98.61 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 118.844 -1.143 . . . . 10.0 110.758 179.496 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 34.3 m -55.51 -42.66 74.8 Favored 'General case' 0 CA--C 1.532 0.265 0 O-C-N 121.847 -0.533 . . . . 10.0 111.226 179.583 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.428 ' HG ' HG12 ' A' ' 35' ' ' VAL . 0.0 OUTLIER -67.35 -50.84 58.23 Favored 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 109.265 -0.642 . . . . 10.0 109.265 174.425 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -47.03 -45.58 21.47 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.602 1.161 . . . . 10.0 112.869 -177.577 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 42.7 t -42.94 -69.08 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.384 0 C-N-CA 124.859 1.264 . . . . 10.0 112.319 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 58.8 m-80 -148.94 59.39 1.05 Allowed 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 122.912 0.485 . . . . 10.0 110.957 -178.655 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -57.45 -21.37 36.62 Favored 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 114.892 1.442 . . . . 10.0 114.892 178.623 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -51.92 -33.42 37.11 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 123.527 0.731 . . . . 10.0 110.738 172.557 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 16.5 m -50.78 148.0 4.4 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 121.914 0.864 . . . . 10.0 111.674 174.276 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 74.2 mt-10 -63.04 149.21 45.59 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 115.088 -0.96 . . . . 10.0 109.089 164.015 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 37.8 tp -94.13 157.62 15.99 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 106.793 -1.558 . . . . 10.0 106.793 162.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 45.9 mttp -137.65 152.08 48.96 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 118.49 0.586 . . . . 10.0 110.046 173.342 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 48.0 p90 -49.32 -42.96 43.07 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 124.465 1.106 . . . . 10.0 113.63 -163.071 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 17.5 p-10 -63.38 -37.88 88.99 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.201 0.601 . . . . 10.0 111.335 -179.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -78.45 -46.97 18.45 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 122.965 0.506 . . . . 10.0 109.761 -179.189 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -40.37 -50.31 2.83 Favored 'General case' 0 C--N 1.339 0.132 0 C-N-CA 124.06 0.944 . . . . 10.0 108.833 166.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . 0.409 ' NE1' HG13 ' B' ' 80' ' ' ILE . 0.6 OUTLIER -47.23 -70.33 0.1 Allowed 'General case' 0 N--CA 1.445 -0.724 0 C-N-CA 123.111 0.564 . . . . 10.0 111.63 178.587 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 65.5 mtm-85 -39.52 -51.49 2.18 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.256 0.622 . . . . 10.0 111.46 174.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 5.3 mp -61.29 -45.05 96.08 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-O 118.716 -0.659 . . . . 10.0 112.289 -176.367 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 2.5 pt -69.48 -28.6 38.62 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.358 0 CA-C-N 120.376 1.444 . . . . 10.0 110.299 175.627 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -54.25 -54.62 30.87 Favored Glycine 0 C--N 1.335 0.526 0 N-CA-C 110.319 -1.112 . . . . 10.0 110.319 170.636 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -53.53 -44.11 68.91 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 115.123 -0.538 . . . . 10.0 110.618 171.584 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 20.0 tp -57.23 -47.69 80.72 Favored 'General case' 0 CA--C 1.536 0.419 0 O-C-N 121.298 -0.876 . . . . 10.0 112.518 175.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -56.92 -47.44 80.6 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 120.492 1.496 . . . . 10.0 111.288 173.679 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 42.6 tttt -55.85 -33.33 64.42 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.618 1.567 . . . . 10.0 112.292 177.151 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.407 ' OE1' ' NZ ' ' A' ' 59' ' ' LYS . 23.0 mt-10 -74.62 -79.62 0.09 Allowed 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 127.337 2.255 . . . . 10.0 109.08 169.454 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.446 ' O ' HG23 ' A' ' 87' ' ' ILE . 0.2 OUTLIER -81.56 84.11 1.53 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.244 0 CA-C-O 122.8 1.286 . . . . 10.0 110.041 -173.556 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 49.2 mtt180 -81.16 105.87 12.7 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 115.198 -0.91 . . . . 10.0 108.595 179.104 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . 0.418 ' H ' ' CD ' ' A' ' 89' ' ' LYS . 0.3 OUTLIER -48.01 121.76 4.52 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 108.013 -1.106 . . . . 10.0 108.013 169.341 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 65.9 tttp -56.17 -44.99 79.87 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 117.825 0.284 . . . . 10.0 110.71 -174.601 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 46.7 tttm -167.67 -61.75 0.03 OUTLIER 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 107.902 -1.147 . . . . 10.0 107.902 170.205 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -114.04 62.8 0.66 Allowed 'General case' 0 C--O 1.225 -0.215 0 C-N-CA 124.186 0.994 . . . . 10.0 108.777 -165.602 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -46.2 -40.7 11.68 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 114.255 1.205 . . . . 10.0 114.255 -170.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 38.7 mttp -54.62 -21.02 9.26 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 113.394 0.887 . . . . 10.0 113.394 179.336 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 10.5 tt -56.64 -19.43 8.88 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 C-N-CA 123.702 0.801 . . . . 10.0 112.533 171.837 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 78.31 -60.05 0.41 Allowed 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 125.695 1.598 . . . . 10.0 109.148 -178.872 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.03 -44.57 0.06 Allowed 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.558 1.143 . . . . 10.0 109.688 166.804 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 6.9 tmtt? . . . . . 0 C--O 1.253 1.252 1 C-N-CA 133.144 4.578 . . . . 10.0 100.516 -177.072 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . 2.343 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.943 0 N-CA-C 112.206 0.447 . . . . 10.0 112.206 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . 2.339 . . -80.22 179.83 7.46 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 127.047 2.139 . . . . 10.0 111.61 -170.288 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . -119.04 56.32 0.91 Allowed 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 123.423 0.689 . . . . 10.0 112.286 -179.212 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -102.41 175.88 2.09 Favored Pre-proline 0 N--CA 1.464 0.235 0 N-CA-C 104.3 -2.481 . . . . 10.0 104.3 105.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_endo -76.72 45.92 1.76 Allowed 'Trans proline' 0 CA--C 1.543 0.937 0 CA-C-N 122.531 1.94 . . . . 10.0 112.253 -173.504 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -84.28 146.67 27.64 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-O 121.874 0.845 . . . . 10.0 112.052 179.254 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 3.9 m -95.69 157.74 15.76 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 115.697 -0.683 . . . . 10.0 110.657 179.167 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 8' ' ' GLU . . . . . 0.403 ' H ' ' CD ' ' B' ' 8' ' ' GLU . 1.3 mp0 -39.25 -38.06 0.48 Allowed 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 130.188 3.395 . . . . 10.0 113.135 177.05 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -58.63 -60.96 3.0 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 109.146 -0.687 . . . . 10.0 109.146 174.579 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 10' ' ' GLU . . . . . 0.401 ' OE2' ' NZ ' ' A' ' 89' ' ' LYS . 4.4 tp10 -56.94 -43.03 81.08 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.319 1.047 . . . . 10.0 110.744 176.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -46.03 -36.34 5.58 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 124.09 0.956 . . . . 10.0 111.275 172.826 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 19.6 m -74.71 -35.62 62.7 Favored 'General case' 0 N--CA 1.453 -0.311 0 O-C-N 121.08 -1.013 . . . . 10.0 108.937 -176.237 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 74.0 mt -70.55 -48.64 57.86 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.755 0 C-N-CA 124.251 1.02 . . . . 10.0 108.581 -174.427 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 14' ' ' GLU . . . . . 0.418 ' HA ' HG22 ' B' ' 17' ' ' VAL . 4.1 pt-20 -57.05 -38.81 73.76 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 120.245 -0.582 . . . . 10.0 111.263 175.277 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 83.5 m -61.52 -49.53 76.35 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 122.712 0.405 . . . . 10.0 110.302 176.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 52.9 t -56.68 -55.39 19.9 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 O-C-N 121.431 -0.793 . . . . 10.0 110.367 176.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.418 HG22 ' HA ' ' B' ' 14' ' ' GLU . 30.5 m -60.29 -41.05 85.69 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 C-N-CA 120.096 -0.641 . . . . 10.0 111.522 -175.647 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 12.6 m -50.63 -52.16 42.16 Favored 'General case' 0 N--CA 1.457 -0.1 0 C-N-CA 123.872 0.869 . . . . 10.0 110.258 169.852 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 56.4 m -67.04 -19.82 65.74 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 112.767 0.655 . . . . 10.0 112.767 -169.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 67.5 m-85 -56.85 -41.81 78.58 Favored 'General case' 0 N--CA 1.466 0.354 0 O-C-N 120.685 -1.26 . . . . 10.0 110.838 164.247 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -71.27 -53.41 14.41 Favored 'General case' 0 C--O 1.232 0.154 0 N-CA-C 108.121 -1.066 . . . . 10.0 108.121 175.369 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 3.5 m -82.46 59.72 4.75 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 108.489 -0.93 . . . . 10.0 108.489 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 19.0 t80 -96.72 -73.39 0.6 Allowed 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 125.7 1.6 . . . . 10.0 107.741 -177.305 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -162.86 57.03 0.2 Allowed 'General case' 0 N--CA 1.455 -0.207 0 N-CA-C 109.03 -0.73 . . . . 10.0 109.03 173.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . 0.26 0.0 OUTLIER 58.33 120.16 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 127.383 2.273 . . . . 10.0 114.179 176.695 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . 2.415 0.1 OUTLIER -160.51 160.01 31.44 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 128.178 2.591 . . . . 10.0 106.159 162.265 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 48.5 mp0 -83.22 61.56 6.17 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 120.028 1.286 . . . . 10.0 109.781 -175.747 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . 91.97 116.7 2.21 Favored Glycine 0 CA--C 1.525 0.673 0 N-CA-C 110.259 -1.136 . . . . 10.0 110.259 -176.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.83 170.5 14.94 Favored 'General case' 0 C--O 1.236 0.368 0 O-C-N 122.408 -0.466 . . . . 10.0 110.862 -177.939 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 57.4 mtpt -82.82 -99.74 0.04 OUTLIER 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 108.484 -0.932 . . . . 10.0 108.484 169.358 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -125.02 -51.38 1.67 Allowed 'General case' 0 CA--C 1.528 0.124 0 C-N-CA 123.526 0.73 . . . . 10.0 110.874 -169.856 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 23.7 t -154.38 -161.86 1.3 Allowed 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 106.843 -1.54 . . . . 10.0 106.843 168.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 33' ' ' LEU . . . . . 0.41 HD22 ' H ' ' B' ' 33' ' ' LEU . 1.0 OUTLIER -91.28 -165.05 1.27 Allowed 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 125.068 1.347 . . . . 10.0 108.77 -177.595 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 3.2 m -77.39 159.46 29.46 Favored 'General case' 0 N--CA 1.465 0.295 0 O-C-N 121.444 -0.785 . . . . 10.0 109.248 165.11 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 35' ' ' VAL . . . . . 0.534 HG13 HD13 ' B' ' 71' ' ' LEU . 1.4 t -61.56 -57.45 12.07 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 O-C-N 121.405 -0.809 . . . . 10.0 111.957 -173.037 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -56.16 -53.47 56.71 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 108.539 -0.911 . . . . 10.0 108.539 -176.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 65.6 tt0 -45.62 -60.29 2.28 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 126.214 1.806 . . . . 10.0 109.54 176.403 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 6.1 t80 -42.73 -54.28 4.14 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 124.568 1.147 . . . . 10.0 110.482 174.683 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . 0.27 0.7 OUTLIER -55.86 -44.86 78.45 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 118.147 0.43 . . . . 10.0 111.308 -178.429 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -68.34 -44.85 74.38 Favored 'General case' 0 CA--C 1.527 0.086 0 O-C-N 121.302 -0.874 . . . . 10.0 110.991 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -55.64 -52.36 64.08 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 122.696 0.398 . . . . 10.0 110.312 177.173 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 34.4 m -58.9 -43.08 87.69 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 CA-C-N 119.603 1.092 . . . . 10.0 111.134 177.61 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 46.8 m -52.19 -48.2 65.16 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 118.652 0.66 . . . . 10.0 110.534 174.74 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 50.1 mt-30 -61.86 -46.22 90.36 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 122.984 0.514 . . . . 10.0 111.101 178.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -65.24 -30.05 70.89 Favored 'General case' 0 CA--C 1.528 0.128 0 C-N-CA 123.732 0.813 . . . . 10.0 111.995 -179.011 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 6.0 mp -105.75 71.57 0.24 Allowed Pre-proline 0 CA--C 1.539 0.519 0 C-N-CA 123.896 0.878 . . . . 10.0 110.542 178.301 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_endo -71.44 -10.0 26.16 Favored 'Trans proline' 0 CA--C 1.537 0.66 0 C-N-CA 122.151 1.901 . . . . 10.0 111.681 173.086 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -38.34 -62.72 0.56 Allowed 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 127.248 2.219 . . . . 10.0 112.751 -170.71 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 49.6 tp -141.75 -60.45 0.47 Allowed 'General case' 0 C--O 1.232 0.15 0 CA-C-O 118.602 -0.713 . . . . 10.0 109.814 -175.332 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 31.2 mt 64.97 57.46 0.98 Allowed 'General case' 0 C--N 1.339 0.149 0 C-N-CA 126.442 1.897 . . . . 10.0 109.541 -178.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.26 -36.06 30.38 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 115.367 -0.833 . . . . 10.0 110.997 176.496 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 28.67 89.55 0.01 OUTLIER 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 131.646 3.978 . . . . 10.0 115.445 167.502 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 13.6 p -140.96 163.04 22.06 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.516 0 N-CA-C 106.323 -1.732 . . . . 10.0 106.323 169.728 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 85.11 -114.05 3.9 Favored Glycine 0 CA--C 1.522 0.523 0 N-CA-C 107.159 -2.376 . . . . 10.0 107.159 -167.12 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 55' ' ' SER . . . . . . . . . . . . 0.357 58.8 m -58.72 -14.01 7.47 Favored 'General case' 0 CA--C 1.517 -0.311 0 N-CA-C 115.665 1.728 . . . . 10.0 115.665 -176.223 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.449 HD13 ' C ' ' B' ' 56' ' ' LEU . 2.8 tm? -38.14 -51.89 1.43 Allowed 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 118.679 0.672 . . . . 10.0 109.289 160.409 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -66.17 -63.79 1.0 Allowed 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 118.746 -0.645 . . . . 10.0 111.637 -177.497 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -40.66 -50.44 3.05 Favored 'General case' 0 C--N 1.347 0.492 0 CA-C-N 118.954 0.797 . . . . 10.0 111.484 176.043 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 59' ' ' LYS . . . . . 0.403 ' NZ ' ' OE1' ' B' ' 86' ' ' GLU . 2.9 ttpm? -71.17 -47.31 58.43 Favored 'General case' 0 N--CA 1.443 -0.782 0 CA-C-N 116.002 -0.545 . . . . 10.0 109.79 -173.902 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 28.0 ttt -50.66 -55.37 16.79 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 118.386 0.539 . . . . 10.0 110.007 178.052 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.0 -42.96 94.01 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 118.998 -1.081 . . . . 10.0 110.857 179.74 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 23.3 t -51.76 -45.25 63.64 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 118.144 0.429 . . . . 10.0 111.645 177.557 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.23 -61.2 2.62 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 108.184 -1.043 . . . . 10.0 108.184 172.184 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -39.8 -46.65 1.98 Allowed 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 125.174 1.389 . . . . 10.0 113.285 -170.331 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 39.2 t -37.96 -59.37 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 C-N-CA 125.643 1.577 . . . . 10.0 111.996 -177.376 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 48.0 m-80 -149.01 58.41 1.04 Allowed 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.382 0.61 . . . . 10.0 109.467 176.028 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -62.67 -28.42 69.92 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 113.641 0.978 . . . . 10.0 113.641 -168.496 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -49.85 -41.73 45.86 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 124.312 1.045 . . . . 10.0 111.996 171.713 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 7.4 t -62.06 158.36 16.77 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 121.544 0.687 . . . . 10.0 112.453 -163.658 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 74.3 mt-10 -63.09 127.75 32.67 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.617 -0.72 . . . . 10.0 109.854 171.665 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . 0.534 HD13 HG13 ' B' ' 35' ' ' VAL . 16.0 tp -90.25 152.64 20.97 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 124.9 1.28 . . . . 10.0 108.088 172.709 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 6.9 mptt -121.35 166.61 13.82 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 123.692 0.797 . . . . 10.0 109.652 174.336 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 44.5 p90 -58.44 -38.62 77.85 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 115.8 -0.636 . . . . 10.0 111.394 -170.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -47.74 -60.95 2.19 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.573 1.149 . . . . 10.0 111.59 172.186 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -63.28 -51.67 65.13 Favored 'General case' 0 N--CA 1.455 -0.203 0 O-C-N 121.996 -0.44 . . . . 10.0 110.343 -177.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -41.57 -48.24 3.95 Favored 'General case' 0 C--N 1.341 0.203 0 O-C-N 124.268 0.98 . . . . 10.0 109.64 177.315 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 77' ' ' TRP . . . . . . . . . . . . . 1.3 t-105 -54.99 -66.83 0.34 Allowed 'General case' 0 N--CA 1.442 -0.828 0 O-C-N 123.207 0.317 . . . . 10.0 110.855 -174.062 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 70.2 mtm180 -39.41 -52.42 2.07 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.006 0.922 . . . . 10.0 110.219 172.135 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -59.1 -44.08 91.92 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 112.8 0.667 . . . . 10.0 112.8 -177.011 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . 0.409 HG13 ' NE1' ' A' ' 77' ' ' TRP . 3.0 pt -69.73 -30.96 46.77 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 CA-C-N 120.715 1.598 . . . . 10.0 110.493 174.95 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -54.4 -53.44 38.28 Favored Glycine 0 CA--C 1.525 0.7 0 N-CA-C 111.034 -0.827 . . . . 10.0 111.034 171.299 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -55.08 -44.78 75.16 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 125.62 1.568 . . . . 10.0 109.944 172.367 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -55.28 -49.2 72.71 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 121.222 -0.924 . . . . 10.0 110.834 174.118 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -56.81 -41.67 78.18 Favored 'General case' 0 CA--C 1.541 0.598 0 O-C-N 120.318 -1.488 . . . . 10.0 112.16 171.419 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 24.5 tttt -55.93 -41.69 75.0 Favored 'General case' 0 CA--C 1.536 0.421 0 O-C-N 121.34 -0.85 . . . . 10.0 110.54 177.323 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . 0.403 ' OE1' ' NZ ' ' B' ' 59' ' ' LYS . 19.6 mt-10 -69.07 -75.84 0.1 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 128.106 2.562 . . . . 10.0 110.413 176.29 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 87' ' ' ILE . . . . . 0.42 HG23 ' O ' ' B' ' 87' ' ' ILE . 0.2 OUTLIER -81.56 85.35 1.6 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.375 0 N-CA-C 107.748 -1.205 . . . . 10.0 107.748 -178.584 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 51.3 mtp85 -80.87 66.7 6.49 Favored 'General case' 0 CA--C 1.531 0.227 0 N-CA-C 109.258 -0.645 . . . . 10.0 109.258 -173.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -46.64 -53.48 11.49 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 124.939 1.296 . . . . 10.0 111.967 -174.544 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 63.84 -70.63 0.07 Allowed 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 126.113 1.765 . . . . 10.0 114.208 162.701 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 91' ' ' LYS . . . . . 0.4 ' NZ ' ' OD1' ' B' ' 92' ' ' ASP . 39.2 tttm -118.57 -61.82 1.61 Allowed 'General case' 0 N--CA 1.456 -0.149 0 C-N-CA 125.476 1.51 . . . . 10.0 109.177 -174.605 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 92' ' ' ASP . . . . . 0.4 ' OD1' ' NZ ' ' B' ' 91' ' ' LYS . 43.8 m-20 -90.96 57.13 3.4 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-O 122.149 0.976 . . . . 10.0 108.404 -163.107 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 93' ' ' LEU . . . . . 0.51 HD11 ' HB2' ' A' ' 14' ' ' GLU . 8.3 tt -81.24 -62.16 1.74 Allowed 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 114.178 -1.373 . . . . 10.0 109.03 -168.765 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 35.7 mttm -74.81 -19.59 60.13 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 115.457 -0.792 . . . . 10.0 110.705 -179.104 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . . 1.9 mp -58.45 -18.9 12.84 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 C-N-CA 124.723 1.209 . . . . 10.0 110.928 167.161 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 70.6 ttt180 76.4 -85.8 0.02 OUTLIER 'General case' 0 C--N 1.341 0.228 0 C-N-CA 123.724 0.81 . . . . 10.0 110.126 167.41 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 22.2 tttp 170.41 -62.15 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 104.762 -2.31 . . . . 10.0 104.762 -164.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.001 0 C-N-CA 130.073 3.349 . . . . 10.0 103.812 153.256 . . . . . . . . 1 1 . 1 stop_ save_