data_2jws_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 2jws _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.4 pp . . . . . 0 N--CA 1.458 -0.072 0 CA-C-O 120.655 0.264 . . . . 0.0 111.056 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 17.4 tttm -54.36 -38.32 65.95 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.146 0.498 . . . . 0.0 110.354 179.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -90.43 -32.91 16.21 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.388 179.393 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.06 -38.27 82.32 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.504 179.377 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.46 ' HG2' ' N ' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -85.41 -36.85 20.41 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.445 179.352 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.46 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 6.1 mm-40 -56.48 -50.45 71.73 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 178.906 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -64.17 -34.24 77.62 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 177.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . 0.493 ' HB1' HD11 ' A' ' 33' ' ' ILE . . . -65.19 -38.87 91.83 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.4 179.391 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.453 HG12 ' O ' ' A' ' 13' ' ' LYS . 26.1 mm -55.62 -50.03 69.85 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.168 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 178.767 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -60.62 -33.18 72.4 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.736 -0.666 . . . . 0.0 109.964 178.642 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.74 -52.47 64.12 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.661 179.496 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.409 ' HG ' ' CD1' ' A' ' 25' ' ' ILE . 0.2 OUTLIER -76.08 -34.28 59.54 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.673 179.886 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.41 ' CG2' ' O ' ' A' ' 17' ' ' ILE . 64.1 t -64.43 -31.2 52.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-O 120.866 0.365 . . . . 0.0 110.086 179.38 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -88.24 -35.95 17.02 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.203 179.313 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -78.84 -15.37 58.46 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.245 179.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 41.87 79.69 0.05 OUTLIER Glycine 0 CA--C 1.522 0.508 0 CA-C-N 116.307 -0.406 . . . . 0.0 113.799 179.451 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.458 ' CG2' ' CZ ' ' A' ' 52' ' ' PHE . 0.1 OUTLIER -144.2 -162.63 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.233 0 CA-C-N 116.812 0.306 . . . . 0.0 110.999 179.346 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -43.25 95.45 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.185 0 CA-C-O 120.863 0.364 . . . . 0.0 111.801 -179.497 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.414 ' O ' ' N ' ' A' ' 30' ' ' ILE . 0.4 OUTLIER -52.87 -26.03 13.48 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.576 179.504 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.96 -45.92 15.95 Favored 'General case' 0 C--O 1.237 0.445 0 CA-C-O 121.344 0.592 . . . . 0.0 110.294 179.223 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.572 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 4.0 m-85 -62.69 -31.82 72.79 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.074 179.657 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.414 ' N ' ' O ' ' A' ' 27' ' ' GLU . 1.8 tt -60.9 -26.56 39.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.0 -0.545 . . . . 0.0 109.659 178.445 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -76.62 -37.64 56.04 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.879 179.738 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.572 ' HG ' ' O ' ' A' ' 29' ' ' TYR . 0.0 OUTLIER -60.99 -32.29 71.87 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 120.034 -0.666 . . . . 0.0 109.941 179.51 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . 0.493 HD11 ' HB1' ' A' ' 16' ' ' ALA . 3.9 pt -91.86 -45.99 14.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.017 179.365 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.38 -29.68 67.88 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.879 -179.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -87.29 -14.55 40.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.006 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.439 ' O ' ' HB2' ' A' ' 37' ' ' LYS . . . 57.75 -131.71 1.36 Allowed 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.115 179.822 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.439 ' HB2' ' O ' ' A' ' 36' ' ' ALA . 0.0 OUTLIER 85.1 -19.24 0.34 Allowed 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 122.611 0.364 . . . . 0.0 111.131 -179.737 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -147.17 77.78 1.46 Allowed 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 179.583 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 14.9 p -40.64 -49.19 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.953 -179.378 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -59.17 -42.68 91.38 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.778 -0.452 . . . . 0.0 109.778 179.373 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -69.15 -47.1 55.32 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.432 -0.889 . . . . 0.0 111.983 178.791 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.438 ' CG1' ' HB3' ' A' ' 13' ' ' LYS . 21.3 t -43.5 -41.59 1.43 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.249 0 CA-C-O 121.135 0.493 . . . . 0.0 110.538 179.322 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 39.2 t-105 -78.18 -32.16 49.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.784 -0.643 . . . . 0.0 110.988 179.512 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.8 m -78.47 -47.37 17.58 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.962 0.41 . . . . 0.0 110.992 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -58.5 -35.1 71.7 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.228 179.525 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.48 ' O ' HG21 ' A' ' 49' ' ' ILE . 1.7 ttpm? -68.12 -59.99 2.82 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.403 179.493 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.11 -31.58 69.06 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.361 179.797 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -77.42 -53.5 7.58 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 115.916 -0.583 . . . . 0.0 111.054 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.531 HG12 ' CB ' ' A' ' 29' ' ' TYR . 7.5 tp -57.01 -24.14 19.78 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.194 0 C-N-CA 120.702 -0.399 . . . . 0.0 111.203 -179.756 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 2.2 tp -80.13 -36.46 35.21 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 178.697 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 23.7 m -57.29 -24.64 56.24 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.622 178.831 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.538 ' C ' ' CD1' ' A' ' 52' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.533 0.29 0 CA-C-O 120.811 0.338 . . . . 0.0 111.042 179.647 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.6 pp . . . . . 0 N--CA 1.455 -0.181 0 CA-C-O 120.887 0.375 . . . . 0.0 111.068 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . 0.405 ' HA ' ' HD3' ' A' ' 13' ' ' LYS . 0.6 OUTLIER -52.22 -35.93 50.84 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.398 179.712 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 4.5 mt-30 -90.51 -32.52 16.3 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.467 179.442 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.432 ' O ' ' HB3' ' A' ' 16' ' ' ALA . . . -60.81 -37.75 83.05 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.371 179.451 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.468 ' HG2' ' N ' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -85.46 -37.47 19.71 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.419 179.466 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.468 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 5.8 mm-40 -57.77 -50.45 73.22 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 179.173 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -65.27 -32.46 74.13 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 177.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . 0.482 ' HB1' HD13 ' A' ' 33' ' ' ILE . . . -66.97 -37.5 84.36 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.42 179.437 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.455 HG12 ' O ' ' A' ' 13' ' ' LYS . 21.0 mm -57.45 -48.21 83.3 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.14 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 178.713 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 18.4 mttt -63.59 -33.3 75.31 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.822 178.568 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.446 ' HB2' ' HA ' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -59.96 -52.24 66.24 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.692 179.53 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.452 ' HG ' HD13 ' A' ' 25' ' ' ILE . 0.3 OUTLIER -75.86 -32.41 59.73 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.747 -179.852 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.414 ' CG2' ' O ' ' A' ' 17' ' ' ILE . 53.9 t -64.3 -31.25 52.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.252 179.408 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -90.32 -38.3 13.46 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.436 179.591 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.442 ' O ' HG13 ' A' ' 25' ' ' ILE . . . -78.77 -15.55 58.28 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.438 179.797 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 40.58 90.04 0.01 OUTLIER Glycine 0 C--N 1.335 0.515 0 CA-C-N 116.344 -0.389 . . . . 0.0 113.739 179.381 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.452 HD13 ' HG ' ' A' ' 20' ' ' LEU . 0.4 OUTLIER -176.2 136.2 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.227 0 CA-C-O 121.072 0.463 . . . . 0.0 111.707 179.445 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . 38.11 89.97 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 115.616 -0.72 . . . . 0.0 112.558 179.696 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.82 -29.38 70.69 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.283 0.563 . . . . 0.0 109.637 178.557 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 2.6 tptt -46.08 -45.19 16.07 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.481 179.11 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.565 ' HA ' ' HG ' ' A' ' 32' ' ' LEU . 3.6 m-85 -64.0 -31.63 72.88 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.085 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 1.6 tt -60.94 -26.19 38.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.732 178.322 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 12.7 tttt -77.89 -37.58 47.67 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.057 179.729 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.565 ' HG ' ' HA ' ' A' ' 29' ' ' TYR . 0.0 OUTLIER -60.69 -32.07 71.31 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 120.214 -0.594 . . . . 0.0 109.839 179.688 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . 0.482 HD13 ' HB1' ' A' ' 16' ' ' ALA . 5.0 pt -91.7 -45.83 14.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.986 179.47 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -60.35 -29.09 68.67 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.003 -179.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 -86.47 -15.8 39.04 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.253 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.527 ' O ' ' CB ' ' A' ' 37' ' ' LYS . . . 59.22 -139.4 0.72 Allowed 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 116.662 -0.245 . . . . 0.0 110.893 179.634 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.527 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 1.4 tptt 94.81 -26.71 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 122.688 0.395 . . . . 0.0 110.855 -179.691 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.2 m -142.95 82.45 1.76 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.461 179.588 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 11.5 p -41.29 -47.66 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.568 -179.484 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -60.39 -43.92 96.15 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.877 -0.416 . . . . 0.0 109.877 179.292 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -67.91 -47.23 61.61 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 120.424 -0.893 . . . . 0.0 111.948 178.815 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.459 ' CG1' ' HB3' ' A' ' 13' ' ' LYS . 21.9 t -43.72 -41.52 1.56 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.259 0 CA-C-O 121.177 0.513 . . . . 0.0 110.584 179.195 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 37.0 t90 -78.59 -30.88 46.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.086 179.497 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.8 m -78.88 -44.93 21.74 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 120.722 0.296 . . . . 0.0 111.105 -179.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 1.2 mt -61.86 -34.13 75.43 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.044 179.572 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.497 ' O ' HG22 ' A' ' 49' ' ' ILE . 1.2 ttpt -68.38 -60.72 2.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.473 179.539 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -58.08 -30.51 66.28 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.247 179.713 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.61 -54.0 6.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.922 179.769 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.506 HG12 ' CB ' ' A' ' 29' ' ' TYR . 5.3 tp -57.67 -24.06 21.68 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.141 0 C-N-CA 120.9 -0.32 . . . . 0.0 111.193 -179.892 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 4.3 tp -80.29 -35.86 35.21 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 178.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 17.3 m -66.26 -15.91 63.59 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.788 179.695 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.537 ' O ' ' CG ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER . . . . . 0 N--CA 1.462 0.165 0 CA-C-O 121.158 0.504 . . . . 0.0 111.509 -179.478 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.6 pp . . . . . 0 N--CA 1.457 -0.089 0 CA-C-O 120.84 0.352 . . . . 0.0 111.073 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . 0.415 ' HA ' ' HD3' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -50.85 -37.91 46.01 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.092 0.473 . . . . 0.0 110.627 -179.958 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.0 -32.77 16.62 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.536 179.787 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.91 -37.52 82.56 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.498 179.46 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.473 ' HG2' ' N ' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -85.35 -37.54 19.79 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.477 179.371 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.473 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 2.8 mm-40 -56.86 -50.56 72.1 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 178.947 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -64.33 -34.69 78.74 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 177.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . 0.432 ' HB2' HD13 ' A' ' 33' ' ' ILE . . . -64.46 -37.98 89.41 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.225 179.286 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.466 HG12 ' O ' ' A' ' 13' ' ' LYS . 23.6 mm -56.3 -47.53 81.0 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.158 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 178.689 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 18.2 mttp -62.86 -33.27 74.92 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.912 178.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -61.42 -52.31 65.12 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.636 179.549 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.499 ' HG ' HD12 ' A' ' 25' ' ' ILE . 0.2 OUTLIER -72.51 -35.03 68.02 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.772 -179.963 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.41 ' CG2' ' O ' ' A' ' 17' ' ' ILE . 70.2 t -63.27 -31.17 51.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 120.809 0.338 . . . . 0.0 110.244 179.36 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -88.86 -36.09 16.18 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.463 179.508 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -78.32 -15.42 58.74 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.341 179.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.41 ' C ' HG13 ' A' ' 25' ' ' ILE . . . 41.34 90.43 0.01 OUTLIER Glycine 0 CA--C 1.524 0.612 0 C-N-CA 121.507 -0.378 . . . . 0.0 113.792 179.44 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.499 HD12 ' HG ' ' A' ' 20' ' ' LEU . 0.0 OUTLIER -156.32 -163.54 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 CA-C-N 116.649 0.224 . . . . 0.0 110.915 179.387 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -45.17 95.07 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 120.823 0.344 . . . . 0.0 111.699 -179.613 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.434 ' O ' ' N ' ' A' ' 30' ' ' ILE . 7.8 mt-10 -52.24 -25.64 9.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.778 179.455 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -45.38 -46.81 13.42 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.593 179.402 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.621 ' HA ' ' HG ' ' A' ' 32' ' ' LEU . 1.1 m-85 -62.46 -30.42 71.23 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.283 0.563 . . . . 0.0 109.919 179.706 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.434 ' N ' ' O ' ' A' ' 27' ' ' GLU . 1.3 tt -60.81 -26.25 37.91 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.361 0 CA-C-N 115.778 -0.646 . . . . 0.0 109.361 177.941 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.42 -37.2 57.41 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.64 179.607 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.621 ' HG ' ' HA ' ' A' ' 29' ' ' TYR . 0.1 OUTLIER -59.82 -33.89 72.35 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 120.068 -0.653 . . . . 0.0 109.813 179.359 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . 0.432 HD13 ' HB2' ' A' ' 16' ' ' ALA . 4.2 pt -90.78 -46.71 14.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.966 179.541 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -57.6 -28.64 63.81 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.774 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 16.6 t-20 -89.43 -15.72 32.54 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.944 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.492 ' O ' ' CB ' ' A' ' 37' ' ' LYS . . . 59.08 -134.95 0.89 Allowed 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 116.67 -0.241 . . . . 0.0 110.964 179.633 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.492 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 5.6 ttmm 89.98 -22.61 0.11 Allowed 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 122.699 0.4 . . . . 0.0 111.145 -179.894 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.2 m -145.67 79.0 1.56 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.396 179.675 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.413 ' HA ' HG23 ' A' ' 42' ' ' VAL . 10.0 p -39.54 -48.54 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.426 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.641 -179.63 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.469 ' HA ' ' CZ2' ' A' ' 43' ' ' TRP . 3.1 mt-10 -58.08 -45.72 86.66 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 179.369 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -69.13 -43.59 71.09 Favored Glycine 0 N--CA 1.447 -0.594 0 C-N-CA 120.408 -0.901 . . . . 0.0 112.182 178.844 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.432 ' CG1' ' HB3' ' A' ' 13' ' ' LYS . 23.7 t -43.27 -46.69 1.49 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.175 0 CA-C-O 120.879 0.371 . . . . 0.0 110.834 179.696 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . 0.469 ' CZ2' ' HA ' ' A' ' 40' ' ' GLU . 1.1 p90 -78.47 -27.52 46.33 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 120.612 -0.435 . . . . 0.0 110.979 179.277 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.434 ' N ' ' CD1' ' A' ' 43' ' ' TRP . 3.2 m -76.62 -49.28 16.64 Favored 'General case' 0 N--CA 1.463 0.184 0 C-N-CA 120.75 -0.38 . . . . 0.0 110.839 179.825 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 3.6 mt -59.79 -33.07 71.23 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.224 179.585 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.478 ' O ' HG23 ' A' ' 49' ' ' ILE . 6.7 ttpt -67.97 -59.0 3.6 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.359 179.562 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -60.66 -31.71 70.92 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.241 179.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -76.23 -52.64 9.61 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.931 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.507 ' O ' ' CD1' ' A' ' 52' ' ' PHE . 7.4 tp -58.43 -23.97 23.83 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.257 0 C-N-CA 120.784 -0.367 . . . . 0.0 111.16 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 1.5 tp -79.24 -34.94 42.3 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 178.549 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 34.3 m -61.26 -24.32 66.3 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.313 179.238 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.515 ' C ' ' CD1' ' A' ' 52' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.533 0.296 0 CA-C-O 120.914 0.388 . . . . 0.0 111.179 -179.88 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.0 pp . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.909 0.385 . . . . 0.0 110.627 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . 0.42 ' HA ' ' HD3' ' A' ' 13' ' ' LYS . 0.7 OUTLIER -53.61 -37.8 63.38 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.247 179.55 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -89.88 -32.64 16.78 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.347 179.441 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.88 -38.28 81.76 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.321 179.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.431 ' HG2' ' N ' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -85.46 -35.16 21.4 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.636 179.394 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.457 ' O ' HG23 ' A' ' 17' ' ' ILE . 2.1 mm-40 -60.43 -50.44 73.57 Favored 'General case' 0 C--O 1.234 0.263 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 179.049 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -64.41 -34.49 78.3 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 178.026 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . 0.449 ' CB ' ' HB2' ' A' ' 46' ' ' LYS . . . -67.26 -36.34 81.4 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 115.177 -0.919 . . . . 0.0 110.436 179.587 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.502 HG23 ' N ' ' A' ' 18' ' ' LYS . 1.8 tp -59.9 -33.55 53.06 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.209 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 179.18 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.502 ' N ' HG23 ' A' ' 17' ' ' ILE . 4.5 mttp -76.7 -33.21 58.23 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.583 178.348 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.42 ' HB3' HD11 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -59.05 -52.44 65.72 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.677 179.419 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.491 ' HG ' ' CD1' ' A' ' 25' ' ' ILE . 0.3 OUTLIER -71.41 -35.86 71.13 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.895 -179.842 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.42 ' CG2' ' O ' ' A' ' 17' ' ' ILE . 41.1 t -62.33 -31.28 51.18 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-O 120.982 0.42 . . . . 0.0 110.119 179.28 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -88.58 -35.27 16.99 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.96 179.14 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -77.12 -15.19 59.64 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.17 179.45 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 39.66 85.93 0.01 OUTLIER Glycine 0 CA--C 1.521 0.449 0 CA-C-N 116.235 -0.439 . . . . 0.0 113.905 179.358 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.491 ' CD1' ' HG ' ' A' ' 20' ' ' LEU . 0.8 OUTLIER -163.41 -171.18 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 CA-C-N 116.716 0.258 . . . . 0.0 111.118 179.15 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -28.78 95.73 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -179.096 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.446 ' O ' ' N ' ' A' ' 30' ' ' ILE . 0.3 OUTLIER -58.96 -25.54 63.65 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.464 179.46 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -44.15 -46.6 8.84 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.681 179.473 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.603 ' HA ' ' HG ' ' A' ' 32' ' ' LEU . 3.5 m-85 -62.39 -31.24 71.88 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.291 0.567 . . . . 0.0 110.169 179.743 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.446 ' N ' ' O ' ' A' ' 27' ' ' GLU . 1.9 tt -60.79 -26.28 37.94 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.485 178.149 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 13.9 tttt -76.54 -37.13 57.14 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.704 179.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.603 ' HG ' ' HA ' ' A' ' 29' ' ' TYR . 0.1 OUTLIER -60.73 -32.67 71.93 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 120.095 -0.642 . . . . 0.0 109.834 179.494 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . 0.438 HD13 ' HB3' ' A' ' 16' ' ' ALA . 5.1 pt -91.5 -45.62 14.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.966 179.444 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.56 -28.94 67.56 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.868 -179.823 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 20.6 t30 -87.97 -14.37 39.34 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.174 -179.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.533 ' O ' ' CB ' ' A' ' 37' ' ' LYS . . . 57.28 -139.42 0.88 Allowed 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 116.738 -0.21 . . . . 0.0 111.085 179.553 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.533 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 0.9 OUTLIER 95.44 -27.38 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 122.843 0.457 . . . . 0.0 110.734 -179.752 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -142.25 82.89 1.81 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.3 179.564 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 14.8 p -41.83 -47.21 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.307 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.658 -179.64 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.2 -43.29 96.04 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 179.254 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -68.87 -46.96 58.04 Favored Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.481 -0.866 . . . . 0.0 112.008 178.791 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.425 ' CG1' ' HB3' ' A' ' 13' ' ' LYS . 21.7 t -43.88 -41.88 1.7 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-O 121.135 0.493 . . . . 0.0 110.518 179.18 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 64.1 t-105 -77.71 -31.69 52.45 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.094 179.438 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.8 m -78.61 -44.6 23.56 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 120.748 0.309 . . . . 0.0 111.085 -179.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -60.58 -35.07 75.19 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.083 179.479 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.485 ' O ' HG23 ' A' ' 49' ' ' ILE . 0.8 OUTLIER -68.24 -60.38 2.51 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.459 179.554 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -59.47 -29.73 68.03 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.322 179.739 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -78.14 -54.24 6.47 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.974 179.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.598 ' O ' ' HD2' ' A' ' 52' ' ' PHE . 8.6 tp -56.1 -24.32 17.48 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 C-N-CA 120.828 -0.349 . . . . 0.0 111.061 -179.735 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.42 HD11 ' HB3' ' A' ' 19' ' ' GLU . 1.2 tp -81.07 -35.7 31.4 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 178.526 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 7.5 m -55.58 -27.37 48.87 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.244 178.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.598 ' HD2' ' O ' ' A' ' 49' ' ' ILE . 0.0 OUTLIER . . . . . 0 CA--C 1.531 0.223 0 CA-C-O 120.874 0.369 . . . . 0.0 110.27 178.836 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.401 ' HB3' ' HA ' ' A' ' 39' ' ' VAL . 3.1 pp . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.741 0.305 . . . . 0.0 110.912 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 7.7 tttm -52.03 -38.84 58.33 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.032 0.444 . . . . 0.0 110.514 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.28 -33.2 18.13 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.445 179.553 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.64 -37.54 78.94 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.584 179.465 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.453 ' HG2' ' N ' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -85.42 -35.97 20.96 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.526 179.425 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.453 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 23.9 mt-10 -57.04 -50.41 72.84 Favored 'General case' 0 C--O 1.237 0.403 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 178.915 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -63.96 -33.89 76.75 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 177.666 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . 0.501 ' HB2' HD13 ' A' ' 33' ' ' ILE . . . -64.55 -38.49 91.18 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.205 179.246 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.442 HG12 ' O ' ' A' ' 13' ' ' LYS . 26.7 mm -56.12 -52.49 50.01 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.13 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 178.823 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.38 -33.06 70.73 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.845 178.58 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.424 ' HB3' HD13 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -59.95 -52.24 66.23 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.382 179.324 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.488 ' HG ' ' CD1' ' A' ' 25' ' ' ILE . 0.3 OUTLIER -72.74 -32.31 65.58 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.418 179.748 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 87.9 t -62.6 -32.11 54.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 120.904 0.383 . . . . 0.0 110.276 179.328 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.4 ' OD2' ' HA ' ' A' ' 19' ' ' GLU . 1.5 p30 -88.19 -40.12 13.95 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.28 179.412 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.32 -15.28 60.96 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.178 179.424 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.412 ' C ' HG13 ' A' ' 25' ' ' ILE . . . 37.57 89.55 0.01 OUTLIER Glycine 0 CA--C 1.522 0.525 0 CA-C-N 116.121 -0.491 . . . . 0.0 114.036 179.296 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.488 ' CD1' ' HG ' ' A' ' 20' ' ' LEU . 0.5 OUTLIER -159.08 -168.83 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.214 0 CA-C-N 116.653 0.227 . . . . 0.0 111.058 179.285 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -33.47 95.73 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -179.269 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.429 ' O ' ' N ' ' A' ' 30' ' ' ILE . 1.3 mp0 -54.41 -25.68 26.16 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.562 179.562 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.4 tptt -44.57 -46.37 9.94 Favored 'General case' 0 C--O 1.238 0.489 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.608 179.519 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.565 ' HA ' ' HG ' ' A' ' 32' ' ' LEU . 3.3 m-85 -62.97 -31.66 72.82 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.189 0.518 . . . . 0.0 110.209 179.819 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.429 ' N ' ' O ' ' A' ' 27' ' ' GLU . 2.0 tt -60.61 -26.17 37.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.683 178.347 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 7.1 tptt -77.44 -37.67 51.13 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.884 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.565 ' HG ' ' HA ' ' A' ' 29' ' ' TYR . 0.0 OUTLIER -60.96 -31.88 71.43 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 120.044 -0.662 . . . . 0.0 110.027 179.583 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . 0.501 HD13 ' HB2' ' A' ' 16' ' ' ALA . 3.2 pt -91.72 -46.05 14.4 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.938 179.371 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -58.75 -28.87 66.31 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.953 -179.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 16.6 t-20 -89.12 -13.54 38.27 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.058 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.529 ' O ' ' CB ' ' A' ' 37' ' ' LYS . . . 58.14 -136.32 0.95 Allowed 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 116.69 -0.232 . . . . 0.0 111.054 179.643 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.529 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 24.2 tttt 94.8 -26.86 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 122.767 0.427 . . . . 0.0 110.718 -179.701 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -144.4 83.17 1.71 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.31 179.673 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.401 ' HA ' ' HB3' ' A' ' 9' ' ' LEU . 12.9 p -41.34 -47.52 0.79 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.651 -179.598 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -60.6 -43.27 97.61 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 179.194 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -67.75 -46.52 67.27 Favored Glycine 0 N--CA 1.448 -0.567 0 C-N-CA 120.526 -0.845 . . . . 0.0 111.884 178.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.423 ' CG1' ' HB3' ' A' ' 13' ' ' LYS . 20.7 t -45.19 -39.63 2.25 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 CA-C-O 121.171 0.51 . . . . 0.0 110.494 179.281 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 1.9 t90 -79.56 -30.41 41.67 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.87 179.336 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.7 m -78.93 -48.25 14.92 Favored 'General case' 0 C--N 1.334 -0.084 0 CA-C-O 120.892 0.377 . . . . 0.0 110.836 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 1.5 mt -59.3 -34.7 72.62 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.145 179.564 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.506 ' O ' HG22 ' A' ' 49' ' ' ILE . 3.5 ttpp -68.51 -59.02 3.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.416 179.495 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.02 -30.1 67.76 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.223 179.676 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -78.04 -54.32 6.41 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.847 179.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.558 ' O ' ' HD1' ' A' ' 52' ' ' PHE . 4.1 tp -56.6 -23.93 18.15 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.208 0 C-N-CA 120.858 -0.337 . . . . 0.0 110.923 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.424 HD13 ' HB3' ' A' ' 19' ' ' GLU . 3.4 tp -80.74 -33.52 35.06 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 178.525 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 38.1 m -60.13 -26.34 66.19 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.617 -0.72 . . . . 0.0 111.199 179.462 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.759 ' O ' ' CG ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.537 0.466 0 CA-C-O 121.466 0.651 . . . . 0.0 111.01 -179.803 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.1 pp . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.813 0.339 . . . . 0.0 110.977 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . 0.419 ' O ' ' HB3' ' A' ' 14' ' ' GLU . 12.4 tttp -50.66 -37.38 40.54 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.571 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -89.97 -29.26 18.58 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.703 179.705 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.99 -38.25 90.41 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.172 179.298 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.433 ' HG2' ' N ' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -85.6 -35.26 21.13 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.06 179.725 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.433 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 0.4 OUTLIER -59.15 -43.96 92.07 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.58 0.705 . . . . 0.0 109.238 179.035 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.402 ' N ' ' HG3' ' A' ' 14' ' ' GLU . 3.9 tp10 -70.75 -31.08 67.76 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.442 -0.799 . . . . 0.0 108.973 177.941 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . 0.451 ' HA ' ' HG3' ' A' ' 46' ' ' LYS . . . -70.42 -41.82 72.42 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 115.217 -0.901 . . . . 0.0 111.307 -179.743 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.494 HG23 ' N ' ' A' ' 18' ' ' LYS . 0.8 OUTLIER -60.09 -35.51 61.91 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.285 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 179.305 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.494 ' N ' HG23 ' A' ' 17' ' ' ILE . 0.2 OUTLIER -70.48 -32.5 70.04 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 108.979 -0.749 . . . . 0.0 108.979 177.54 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.429 ' HB2' ' HA ' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -63.44 -52.53 61.08 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.16 -0.927 . . . . 0.0 111.266 179.801 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.461 ' HG ' HG13 ' A' ' 25' ' ' ILE . 0.2 OUTLIER -77.45 -35.18 54.16 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.192 -179.461 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.426 ' CG2' ' O ' ' A' ' 17' ' ' ILE . 37.1 t -65.22 -31.01 52.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 120.883 0.373 . . . . 0.0 110.298 179.57 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 23.2 m-20 -91.12 -33.18 15.56 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.7 179.747 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -83.8 -14.96 50.13 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.526 179.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.425 ' C ' ' CG1' ' A' ' 25' ' ' ILE . . . 55.18 112.46 0.01 OUTLIER Glycine 0 CA--C 1.523 0.586 0 C-N-CA 121.071 -0.585 . . . . 0.0 112.951 179.481 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.461 HG13 ' HG ' ' A' ' 20' ' ' LEU . 0.0 OUTLIER -178.82 -173.69 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.357 0 CA-C-N 117.165 0.482 . . . . 0.0 111.407 179.478 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -43.77 94.56 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.133 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.832 -179.421 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.409 ' O ' ' N ' ' A' ' 30' ' ' ILE . 3.0 mt-10 -50.86 -26.74 6.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.528 179.347 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -46.67 -46.33 19.9 Favored 'General case' 0 C--O 1.238 0.483 0 CA-C-O 121.325 0.584 . . . . 0.0 110.211 179.055 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.621 ' HA ' ' HG ' ' A' ' 32' ' ' LEU . 3.0 m-85 -62.08 -32.13 72.64 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 121.41 0.624 . . . . 0.0 109.767 179.413 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.438 ' O ' HG13 ' A' ' 33' ' ' ILE . 1.2 tt -60.59 -26.25 37.2 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.659 178.31 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.4 ttpt -76.2 -36.56 58.56 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.606 179.471 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.621 ' HG ' ' HA ' ' A' ' 29' ' ' TYR . 0.2 OUTLIER -59.73 -34.03 72.4 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 120.394 -0.523 . . . . 0.0 109.76 179.188 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . 0.451 HD11 ' HB2' ' A' ' 16' ' ' ALA . 2.9 pt -91.82 -45.56 14.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.959 179.6 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.67 -29.41 68.04 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.771 -179.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 30.7 t30 -87.39 -12.68 45.55 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.031 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.52 ' O ' ' CB ' ' A' ' 37' ' ' LYS . . . 59.28 -134.31 0.9 Allowed 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.062 179.675 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.52 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 1.0 OUTLIER 92.9 -40.59 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 122.79 0.436 . . . . 0.0 110.537 -179.686 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 13.8 p -129.97 82.47 2.07 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.25 179.476 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 12.6 p -41.69 -49.14 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.358 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.772 -179.63 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -58.34 -41.83 85.52 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 179.168 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -68.96 -47.67 53.03 Favored Glycine 0 N--CA 1.448 -0.554 0 C-N-CA 120.609 -0.805 . . . . 0.0 111.982 178.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.419 ' CG1' ' HB3' ' A' ' 13' ' ' LYS . 17.4 t -42.84 -40.78 1.04 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.192 0 CA-C-O 121.191 0.52 . . . . 0.0 110.493 179.23 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 68.0 t-105 -79.21 -32.89 44.12 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.199 179.342 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.6 m -79.79 -49.62 11.75 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-O 120.997 0.427 . . . . 0.0 111.021 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.405 ' O ' HG21 ' A' ' 49' ' ' ILE . 0.4 OUTLIER -56.81 -34.97 68.21 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.033 179.428 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.494 ' O ' HG21 ' A' ' 49' ' ' ILE . 3.5 tttm -68.54 -60.21 2.59 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.4 179.341 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -57.98 -32.27 67.73 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.415 179.714 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -76.18 -53.49 8.2 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.08 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.535 HG12 ' CB ' ' A' ' 29' ' ' TYR . 7.3 tp -57.38 -24.28 21.24 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.171 0 C-N-CA 120.649 -0.42 . . . . 0.0 111.265 -179.777 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 2.2 tp -79.24 -35.84 40.91 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 178.794 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 44.1 m -59.31 -25.44 64.16 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.011 178.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.544 ' O ' ' CG ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.532 0.284 0 CA-C-O 120.924 0.392 . . . . 0.0 111.042 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.4 pp . . . . . 0 C--O 1.23 0.029 0 CA-C-O 120.891 0.377 . . . . 0.0 111.027 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.47 -38.3 53.14 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.734 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.44 -29.12 20.43 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.783 179.691 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.67 -37.05 85.87 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.198 179.466 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.473 ' HG2' ' N ' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -85.27 -37.81 19.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.75 179.54 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.473 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -56.97 -46.73 81.98 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 179.101 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.413 ' N ' ' HG3' ' A' ' 14' ' ' GLU . 6.8 tp10 -66.42 -36.06 81.86 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 177.952 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . 0.506 ' HA ' ' HG3' ' A' ' 46' ' ' LYS . . . -64.22 -39.76 94.64 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 115.147 -0.933 . . . . 0.0 110.193 179.368 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.424 HG12 ' O ' ' A' ' 13' ' ' LYS . 25.7 mm -54.39 -46.91 70.29 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.167 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 178.57 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 24.3 mmtm -62.01 -33.23 73.95 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.717 178.366 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -62.04 -52.53 63.59 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.613 179.55 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.517 ' HG ' ' CD1' ' A' ' 25' ' ' ILE . 0.2 OUTLIER -76.86 -34.4 57.82 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.942 -179.818 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.418 ' CG2' ' O ' ' A' ' 17' ' ' ILE . 52.8 t -63.08 -31.24 51.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 120.866 0.365 . . . . 0.0 110.188 179.535 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -90.26 -35.37 15.34 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.6 179.513 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.415 ' O ' ' O ' ' A' ' 24' ' ' GLY . . . -79.02 -15.26 58.48 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.4 179.732 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.482 ' O ' ' CG2' ' A' ' 25' ' ' ILE . . . 44.37 105.9 0.01 OUTLIER Glycine 0 CA--C 1.526 0.758 0 N-CA-C 114.243 0.457 . . . . 0.0 114.243 179.009 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.517 ' CD1' ' HG ' ' A' ' 20' ' ' LEU . 1.7 pp -176.41 -170.86 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 CA-C-N 116.823 0.312 . . . . 0.0 110.556 178.646 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -35.91 94.97 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.325 0 N-CA-C 112.225 0.454 . . . . 0.0 112.225 -179.387 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.442 ' O ' ' N ' ' A' ' 30' ' ' ILE . 4.7 pt-20 -54.55 -25.38 25.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.67 179.572 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -43.08 -47.68 6.06 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.928 179.457 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.657 ' HA ' ' HG ' ' A' ' 32' ' ' LEU . 3.4 m-85 -63.12 -32.75 74.21 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.292 0.568 . . . . 0.0 110.092 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.442 ' N ' ' O ' ' A' ' 27' ' ' GLU . 1.4 tt -59.71 -26.27 34.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.67 178.295 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.5 tppp? -76.83 -37.06 56.36 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.637 179.583 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.657 ' HG ' ' HA ' ' A' ' 29' ' ' TYR . 0.2 OUTLIER -58.95 -34.06 71.32 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 120.299 -0.56 . . . . 0.0 109.802 179.379 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . 0.428 HG13 ' O ' ' A' ' 30' ' ' ILE . 3.0 pt -91.68 -45.88 14.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.882 179.378 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -57.99 -28.89 64.8 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.747 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 11.0 t-20 -88.05 -15.99 34.83 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.079 179.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.516 ' O ' ' CB ' ' A' ' 37' ' ' LYS . . . 60.31 -137.84 0.65 Allowed 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.985 179.596 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.516 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 2.9 tppt? 93.69 -26.0 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 122.753 0.421 . . . . 0.0 110.87 -179.523 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 10.2 m -142.55 81.61 1.74 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.401 179.566 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 12.3 p -41.95 -47.32 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.349 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.588 -179.693 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.27 -42.43 95.4 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 179.3 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -69.85 -47.59 46.59 Favored Glycine 0 N--CA 1.448 -0.546 0 C-N-CA 120.506 -0.854 . . . . 0.0 111.949 178.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.432 ' CG1' ' HB3' ' A' ' 13' ' ' LYS . 17.0 t -43.14 -41.97 1.24 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.163 0 CA-C-O 121.134 0.492 . . . . 0.0 110.548 179.239 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 2.6 t-105 -77.17 -32.65 56.34 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.762 -0.653 . . . . 0.0 111.02 179.325 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.7 m -80.52 -52.14 7.96 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 120.815 0.341 . . . . 0.0 111.072 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.428 ' O ' HG23 ' A' ' 49' ' ' ILE . 0.4 OUTLIER -53.64 -34.2 57.76 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.922 179.445 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.514 ' O ' HG23 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -69.17 -60.64 2.21 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.02 179.233 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -57.76 -30.82 65.93 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.169 179.659 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -77.01 -52.74 8.82 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.103 179.701 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.514 HG23 ' O ' ' A' ' 46' ' ' LYS . 4.9 tp -57.12 -24.09 20.0 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.22 0 C-N-CA 120.589 -0.444 . . . . 0.0 111.054 -179.846 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 1.5 tp -80.09 -35.14 37.32 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 178.735 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 50.2 m -57.68 -27.85 63.26 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.74 178.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.555 ' C ' ' CD1' ' A' ' 52' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.531 0.225 0 CA-C-O 120.782 0.325 . . . . 0.0 110.918 179.636 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.424 ' HB2' ' CB ' ' A' ' 39' ' ' VAL . 4.6 tt . . . . . 0 N--CA 1.451 -0.379 0 CA-C-O 120.843 0.354 . . . . 0.0 111.18 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -54.5 -36.67 64.45 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.51 179.769 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -87.04 -32.33 20.05 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.381 179.511 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.64 -37.24 78.14 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.481 179.408 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.469 ' HG2' ' N ' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -85.1 -36.65 21.0 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.478 179.593 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.469 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 1.9 mm-40 -58.39 -50.39 73.86 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 178.949 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 56.5 tt0 -63.36 -34.55 77.97 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 177.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . 0.475 ' HB3' HD12 ' A' ' 33' ' ' ILE . . . -63.57 -36.39 83.64 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 115.153 -0.93 . . . . 0.0 110.173 179.239 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.452 HG12 ' O ' ' A' ' 13' ' ' LYS . 20.4 mm -57.75 -49.17 81.73 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.139 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 178.762 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 20.4 mmtt -61.3 -33.14 73.08 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.97 178.651 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.01 -52.45 65.72 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.622 179.56 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.448 ' O ' ' N ' ' A' ' 24' ' ' GLY . 0.2 OUTLIER -76.16 -29.81 57.87 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.537 179.772 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 66.5 t -67.54 -31.2 51.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.959 0.409 . . . . 0.0 110.095 179.355 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -90.22 -33.84 16.03 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.191 179.423 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -84.66 -15.01 46.87 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.2 179.466 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.448 ' N ' ' O ' ' A' ' 20' ' ' LEU . . . 40.4 86.19 0.01 OUTLIER Glycine 0 C--N 1.334 0.444 0 CA-C-N 116.299 -0.409 . . . . 0.0 113.645 179.576 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.508 ' HB ' ' CE1' ' A' ' 52' ' ' PHE . 1.2 pp -172.66 138.54 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 CA-C-O 121.058 0.456 . . . . 0.0 112.033 179.53 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . 35.82 86.83 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 115.575 -0.739 . . . . 0.0 112.75 179.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -61.66 -28.58 69.49 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.164 0.507 . . . . 0.0 109.669 178.606 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -45.92 -45.8 15.66 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.639 179.06 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.606 ' HA ' ' HG ' ' A' ' 32' ' ' LEU . 3.4 m-85 -65.58 -30.07 70.75 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.156 0.503 . . . . 0.0 110.284 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 1.9 tt -61.8 -26.21 39.19 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 178.079 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.2 tppp? -76.33 -38.06 56.48 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.676 179.588 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.606 ' HG ' ' HA ' ' A' ' 29' ' ' TYR . 0.1 OUTLIER -59.72 -33.57 71.8 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 120.117 -0.633 . . . . 0.0 109.92 179.445 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . 0.475 HD12 ' HB3' ' A' ' 16' ' ' ALA . 4.7 pt -90.18 -48.41 14.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.795 179.397 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -56.28 -28.07 57.48 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.95 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 20.9 t30 -91.54 -15.57 28.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.159 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.564 ' O ' ' CB ' ' A' ' 37' ' ' LYS . . . 60.58 -162.81 0.26 Allowed 'General case' 0 C--N 1.333 -0.11 0 CA-C-O 120.499 0.19 . . . . 0.0 111.005 179.673 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.564 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 6.3 tttt 138.14 -52.97 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 123.786 0.834 . . . . 0.0 109.081 -179.478 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -129.24 101.74 6.14 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.333 -0.849 . . . . 0.0 109.847 178.946 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.424 ' CB ' ' HB2' ' A' ' 9' ' ' LEU . 10.4 p -42.39 -38.09 0.77 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.326 0 CA-C-O 121.301 0.572 . . . . 0.0 110.81 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -69.84 -44.99 68.77 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.469 -0.787 . . . . 0.0 109.701 179.239 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -63.75 -45.16 95.08 Favored Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 120.349 -0.929 . . . . 0.0 111.335 178.745 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.449 ' CG1' ' HB3' ' A' ' 13' ' ' LYS . 11.7 t -48.18 -41.84 10.57 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-O 121.194 0.521 . . . . 0.0 110.008 178.919 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 48.2 t90 -77.34 -27.81 52.85 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.529 -0.76 . . . . 0.0 111.097 179.379 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.8 m -80.8 -48.84 11.9 Favored 'General case' 0 C--N 1.334 -0.107 0 CA-C-O 120.814 0.34 . . . . 0.0 111.035 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -58.61 -34.75 71.49 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.103 179.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.512 ' O ' HG22 ' A' ' 49' ' ' ILE . 12.2 tttm -68.46 -59.89 2.83 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.63 -0.713 . . . . 0.0 110.305 179.379 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -58.47 -31.03 67.44 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.361 179.681 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -77.1 -53.12 8.18 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.835 -0.621 . . . . 0.0 111.081 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.541 ' O ' ' HD1' ' A' ' 52' ' ' PHE . 4.6 tp -57.49 -23.91 20.77 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.143 0 C-N-CA 120.824 -0.35 . . . . 0.0 111.179 -179.872 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 2.0 tp -81.69 -32.34 31.75 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.692 -0.484 . . . . 0.0 109.692 178.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 17.0 m -64.79 -23.74 67.34 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.706 179.767 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.541 ' HD1' ' O ' ' A' ' 49' ' ' ILE . 0.0 OUTLIER . . . . . 0 N--CA 1.464 0.263 0 CA-C-O 121.245 0.545 . . . . 0.0 111.351 179.871 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.432 ' HB2' ' CB ' ' A' ' 39' ' ' VAL . 6.5 tt . . . . . 0 N--CA 1.45 -0.438 0 CA-C-O 120.825 0.345 . . . . 0.0 111.43 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 4.9 mtpt -52.92 -37.79 61.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.8 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -87.52 -29.13 21.56 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.861 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.403 ' HB3' ' HA ' ' A' ' 9' ' ' LEU . . . -63.58 -36.62 84.39 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.196 179.497 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.469 ' HB3' ' CG1' ' A' ' 42' ' ' VAL . 0.0 OUTLIER -85.27 -36.38 20.92 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.903 179.549 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.454 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 5.4 pt-20 -59.87 -50.11 75.08 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 179.159 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.443 ' N ' ' CG ' ' A' ' 14' ' ' GLU . 1.1 tp10 -65.0 -36.32 84.04 Favored 'General case' 0 CA--C 1.516 -0.345 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 178.183 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . 0.45 ' CB ' ' HB2' ' A' ' 46' ' ' LYS . . . -64.45 -34.29 77.86 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 115.234 -0.893 . . . . 0.0 110.308 179.461 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.412 ' O ' ' CG2' ' A' ' 21' ' ' VAL . 1.3 mp -59.81 -45.83 94.37 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.277 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 178.808 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 11.3 mttt -65.46 -33.07 75.09 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.56 -0.746 . . . . 0.0 109.966 178.629 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.411 ' HB3' HD13 ' A' ' 50' ' ' LEU . 0.5 OUTLIER -56.88 -52.58 64.57 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.315 179.996 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.419 ' HG ' HG13 ' A' ' 25' ' ' ILE . 0.2 OUTLIER -77.63 -32.76 53.63 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.768 0.318 . . . . 0.0 110.711 -179.859 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.412 ' CG2' ' O ' ' A' ' 17' ' ' ILE . 55.6 t -62.82 -31.39 52.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-O 120.87 0.367 . . . . 0.0 110.203 179.464 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -90.82 -36.98 13.91 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.2 179.368 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -77.07 -14.92 59.75 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.072 179.367 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.408 ' N ' ' O ' ' A' ' 20' ' ' LEU . . . 49.71 100.99 0.01 OUTLIER Glycine 0 CA--C 1.523 0.533 0 C-N-CA 121.185 -0.531 . . . . 0.0 113.274 179.447 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.441 HG23 ' CE1' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -168.84 -169.55 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.253 0 CA-C-N 117.029 0.415 . . . . 0.0 111.403 179.345 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -43.24 95.33 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.006 -0.543 . . . . 0.0 112.143 -179.401 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.415 ' O ' ' N ' ' A' ' 30' ' ' ILE . 0.6 OUTLIER -52.61 -25.9 11.97 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.292 0.568 . . . . 0.0 110.513 179.107 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.9 tptm -46.3 -44.91 17.01 Favored 'General case' 0 C--O 1.238 0.493 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.168 179.067 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.584 ' HA ' ' HG ' ' A' ' 32' ' ' LEU . 2.7 m-85 -61.46 -31.8 71.78 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.003 179.72 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.429 ' O ' HG13 ' A' ' 33' ' ' ILE . 43.6 mt -60.65 -26.47 38.06 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.331 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 177.97 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -74.98 -37.32 61.94 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.694 179.429 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.584 ' HG ' ' HA ' ' A' ' 29' ' ' TYR . 0.1 OUTLIER -60.52 -33.37 72.55 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 120.03 -0.668 . . . . 0.0 109.841 179.55 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . 0.437 HD12 HG22 ' A' ' 33' ' ' ILE . 3.7 pt -91.72 -46.69 14.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.987 179.619 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -58.71 -29.51 66.73 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.741 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 -85.06 -12.91 51.96 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.921 179.841 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.545 ' O ' ' CB ' ' A' ' 37' ' ' LYS . . . 58.59 -139.9 0.76 Allowed 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 116.656 -0.247 . . . . 0.0 110.97 179.445 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.545 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 0.4 OUTLIER 95.68 -27.12 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 122.797 0.439 . . . . 0.0 110.796 -179.855 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 55.5 p -143.65 83.14 1.75 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.624 179.671 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.432 ' CB ' ' HB2' ' A' ' 9' ' ' LEU . 8.1 p -40.63 -48.85 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.494 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 30.0 mm-40 -61.58 -41.45 97.43 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.283 -0.417 . . . . 0.0 109.957 179.61 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -68.03 -47.12 61.56 Favored Glycine 0 N--CA 1.448 -0.555 0 C-N-CA 120.519 -0.848 . . . . 0.0 111.788 178.733 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.469 ' CG1' ' HB3' ' A' ' 13' ' ' LYS . 11.9 t -43.8 -41.9 1.65 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.164 0 CA-C-O 121.276 0.56 . . . . 0.0 110.254 179.026 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 73.7 t-105 -78.3 -31.26 48.76 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.549 -0.751 . . . . 0.0 111.304 179.333 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.9 m -79.12 -49.2 12.98 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.84 0.352 . . . . 0.0 110.959 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 1.8 mt -56.88 -34.9 68.32 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.064 -0.516 . . . . 0.0 109.928 179.459 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.481 ' O ' HG21 ' A' ' 49' ' ' ILE . 12.8 tttm -67.87 -59.82 2.99 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.479 179.486 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.74 -32.64 69.41 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.497 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -76.19 -53.65 7.96 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.918 179.885 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.542 HG12 ' CB ' ' A' ' 29' ' ' TYR . 9.1 tp -58.41 -24.4 24.85 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.152 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.162 -179.73 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.411 HD13 ' HB3' ' A' ' 19' ' ' GLU . 4.1 tp -78.87 -34.54 44.86 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 178.753 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 35.6 m -58.35 -34.82 71.07 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.913 179.354 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.794 ' O ' ' CG ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.541 0.613 0 CA-C-O 121.577 0.703 . . . . 0.0 110.76 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 4.0 tt . . . . . 0 N--CA 1.451 -0.382 0 CA-C-O 120.862 0.363 . . . . 0.0 110.643 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . 0.408 ' HA ' ' HD3' ' A' ' 13' ' ' LYS . 3.7 mtmp? -54.18 -32.68 56.18 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.562 179.641 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.414 ' O ' ' HG2' ' A' ' 14' ' ' GLU . 0.8 OUTLIER -87.7 -32.94 18.93 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.55 179.551 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.62 -36.75 76.95 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.269 179.368 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.484 ' HG2' ' N ' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -85.04 -37.99 19.71 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.592 179.406 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.484 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 4.5 pt-20 -56.36 -49.56 74.07 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 178.902 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.424 ' N ' ' CG ' ' A' ' 14' ' ' GLU . 60.4 tt0 -63.38 -34.01 76.8 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 177.64 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . 0.511 ' HB3' HD12 ' A' ' 33' ' ' ILE . . . -63.71 -39.53 94.52 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 115.143 -0.935 . . . . 0.0 109.968 179.073 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.463 HG12 ' O ' ' A' ' 13' ' ' LYS . 28.8 mm -55.61 -49.69 72.12 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.2 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 178.523 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.6 -32.15 70.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.304 -0.862 . . . . 0.0 109.695 178.399 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.42 ' HB3' HD12 ' A' ' 50' ' ' LEU . 0.2 OUTLIER -65.97 -52.47 49.29 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.637 179.533 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.74 -32.97 68.31 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.392 179.768 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 65.4 t -63.87 -31.44 53.18 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.207 0 CA-C-N 116.311 -0.404 . . . . 0.0 109.973 179.113 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -85.19 -38.4 19.03 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.946 179.199 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -76.1 -15.09 60.16 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.968 179.267 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.419 ' C ' HG13 ' A' ' 25' ' ' ILE . . . 39.81 89.8 0.01 OUTLIER Glycine 0 CA--C 1.523 0.552 0 CA-C-N 116.144 -0.48 . . . . 0.0 114.243 179.019 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.419 HG13 ' C ' ' A' ' 24' ' ' GLY . 0.0 OUTLIER -153.43 -167.65 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.268 0 CA-C-N 116.78 0.29 . . . . 0.0 110.702 179.028 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.414 ' HB1' ' CE2' ' A' ' 29' ' ' TYR . . . -46.65 97.22 0.01 OUTLIER 'General case' 0 C--O 1.232 0.149 0 CA-C-O 120.927 0.394 . . . . 0.0 111.344 -179.6 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.489 ' O ' ' N ' ' A' ' 30' ' ' ILE . 0.2 OUTLIER -45.28 -25.43 0.38 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.268 179.574 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -40.95 -48.23 3.13 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 121.436 0.636 . . . . 0.0 110.839 179.463 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.576 ' HA ' ' HG ' ' A' ' 32' ' ' LEU . 58.1 m-85 -60.63 -33.65 73.09 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.14 179.87 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.489 ' N ' ' O ' ' A' ' 27' ' ' GLU . 1.8 tt -60.39 -26.29 36.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.641 -0.709 . . . . 0.0 109.676 178.392 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.32 -36.88 58.07 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.761 179.598 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.576 ' HG ' ' HA ' ' A' ' 29' ' ' TYR . 0.1 OUTLIER -58.88 -33.9 71.03 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 120.229 -0.588 . . . . 0.0 109.634 179.315 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . 0.511 HD12 ' HB3' ' A' ' 16' ' ' ALA . 2.5 pt -91.75 -46.43 14.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.723 179.266 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -58.44 -29.5 66.18 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.757 -179.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 25.6 t30 -84.95 -16.32 41.39 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.015 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.539 ' O ' ' CB ' ' A' ' 37' ' ' LYS . . . 59.07 -136.93 0.81 Allowed 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.137 179.505 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.539 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 25.0 tttt 95.29 -27.32 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 122.851 0.46 . . . . 0.0 110.667 -179.478 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 60.1 p -142.25 83.68 1.84 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.332 179.522 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 8.6 p -39.57 -49.45 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.566 -179.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.62 -43.17 99.35 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.873 -0.418 . . . . 0.0 109.873 179.289 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -65.75 -46.13 84.94 Favored Glycine 0 N--CA 1.447 -0.568 0 C-N-CA 120.447 -0.883 . . . . 0.0 111.724 178.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.455 ' CG1' ' HB3' ' A' ' 13' ' ' LYS . 14.6 t -45.44 -41.6 3.09 Favored 'Isoleucine or valine' 0 C--O 1.233 0.217 0 CA-C-O 121.126 0.489 . . . . 0.0 110.261 179.048 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 69.1 t90 -77.2 -30.57 54.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.0 179.382 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.4 m -79.39 -49.15 12.8 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 120.804 0.335 . . . . 0.0 110.91 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.412 ' O ' HG23 ' A' ' 49' ' ' ILE . 3.5 mm? -56.78 -36.03 69.38 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.239 179.4 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.5 ' O ' HG23 ' A' ' 49' ' ' ILE . 15.5 ttpp -67.83 -58.85 3.89 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.604 179.523 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.48 -32.37 68.7 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.293 179.789 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 17.1 tt0 -77.22 -53.52 7.63 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.981 179.815 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.574 ' O ' ' CD1' ' A' ' 52' ' ' PHE . 3.6 tp -56.61 -23.97 18.26 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.289 0 C-N-CA 120.902 -0.319 . . . . 0.0 111.217 -179.773 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.42 HD12 ' HB3' ' A' ' 19' ' ' GLU . 1.8 tp -81.65 -33.32 31.41 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 178.766 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 17.1 m -64.43 -18.52 64.81 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.66 179.41 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.574 ' CD1' ' O ' ' A' ' 49' ' ' ILE . 0.0 OUTLIER . . . . . 0 CA--C 1.531 0.223 0 CA-C-O 121.338 0.589 . . . . 0.0 111.361 -179.709 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 6.8 tt . . . . . 0 N--CA 1.451 -0.406 0 CA-C-O 120.941 0.4 . . . . 0.0 111.118 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 45.9 tttp -52.79 -35.34 56.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.901 179.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.37 -32.85 19.37 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.62 179.825 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.91 -37.99 77.91 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.314 179.344 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.444 ' HB3' ' CG1' ' A' ' 42' ' ' VAL . 0.0 OUTLIER -85.38 -35.4 21.38 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.784 -0.643 . . . . 0.0 111.021 179.754 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.439 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 0.3 OUTLIER -58.52 -42.18 87.12 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 121.505 0.669 . . . . 0.0 109.299 179.086 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.41 ' N ' ' HG3' ' A' ' 14' ' ' GLU . 0.4 OUTLIER -72.75 -31.1 64.67 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.311 -0.859 . . . . 0.0 108.89 177.864 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . 0.529 ' HB3' HD12 ' A' ' 33' ' ' ILE . . . -69.63 -42.44 74.32 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.184 -0.917 . . . . 0.0 111.335 179.903 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.458 HG21 ' N ' ' A' ' 18' ' ' LYS . 2.2 tp -61.6 -37.35 77.69 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.243 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 179.085 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.458 ' N ' HG21 ' A' ' 17' ' ' ILE . 0.0 OUTLIER -69.64 -32.46 71.16 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 177.491 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.467 ' HB2' ' HA ' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -62.03 -52.68 63.0 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.999 179.479 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.5 ' HG ' HG13 ' A' ' 25' ' ' ILE . 0.2 OUTLIER -74.95 -35.02 62.13 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.133 -179.442 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.421 ' CG2' ' O ' ' A' ' 17' ' ' ILE . 41.8 t -63.58 -31.25 52.24 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-O 120.838 0.351 . . . . 0.0 110.284 179.493 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -91.69 -33.12 15.18 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.638 179.571 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.419 ' O ' ' O ' ' A' ' 24' ' ' GLY . . . -82.48 -15.05 53.91 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.579 179.858 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.419 ' O ' ' O ' ' A' ' 23' ' ' ALA . . . 48.76 105.02 0.01 OUTLIER Glycine 0 CA--C 1.524 0.643 0 C-N-CA 121.136 -0.554 . . . . 0.0 113.104 179.607 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.5 HG13 ' HG ' ' A' ' 20' ' ' LEU . 0.7 OUTLIER -177.43 -173.67 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.199 0 CA-C-N 117.213 0.506 . . . . 0.0 111.709 179.715 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -37.03 95.15 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 115.964 -0.562 . . . . 0.0 112.358 -179.15 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.438 ' O ' ' N ' ' A' ' 30' ' ' ILE . 9.8 tt0 -54.92 -25.36 28.76 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.559 179.143 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.8 tptm -44.63 -47.94 10.46 Favored 'General case' 0 C--O 1.239 0.51 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.699 179.389 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.594 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 2.7 m-85 -64.34 -30.39 71.44 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.278 0.561 . . . . 0.0 109.855 179.582 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.438 ' N ' ' O ' ' A' ' 27' ' ' GLU . 0.6 OUTLIER -61.58 -26.4 39.51 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 CA-C-N 115.846 -0.615 . . . . 0.0 109.402 178.056 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -75.88 -38.06 58.25 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.73 179.524 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.594 ' HG ' ' O ' ' A' ' 29' ' ' TYR . 0.0 OUTLIER -61.02 -32.0 71.61 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 119.962 -0.695 . . . . 0.0 109.876 179.528 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . 0.529 HD12 ' HB3' ' A' ' 16' ' ' ALA . 4.1 pt -91.7 -46.47 14.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.986 179.334 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -58.74 -29.03 66.41 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.807 -179.735 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -89.15 -16.43 31.42 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.963 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.537 ' O ' ' CB ' ' A' ' 37' ' ' LYS . . . 62.52 -139.98 0.42 Allowed 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 116.682 -0.236 . . . . 0.0 111.007 179.603 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.537 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 0.0 OUTLIER 95.83 -27.63 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 122.818 0.447 . . . . 0.0 110.712 -179.73 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.88 83.14 1.87 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.435 179.618 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 9.2 p -40.93 -48.64 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.4 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.501 -179.849 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -62.11 -41.11 97.89 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 179.533 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -67.7 -47.11 63.43 Favored Glycine 0 N--CA 1.448 -0.511 0 C-N-CA 120.483 -0.865 . . . . 0.0 111.84 178.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.444 ' CG1' ' HB3' ' A' ' 13' ' ' LYS . 7.4 t -45.12 -40.43 2.32 Favored 'Isoleucine or valine' 0 C--O 1.232 0.139 0 CA-C-O 121.23 0.538 . . . . 0.0 110.198 179.161 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 60.8 t-105 -77.98 -31.52 50.8 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.985 179.186 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.8 m -78.66 -53.7 6.89 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.867 0.365 . . . . 0.0 110.988 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 3.3 mt -55.14 -34.47 63.79 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.307 179.66 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.512 ' O ' HG23 ' A' ' 49' ' ' ILE . 4.9 tttm -67.48 -58.64 4.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.229 179.446 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -60.5 -30.16 69.54 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.392 179.792 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -78.5 -53.15 7.53 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.109 179.847 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.563 ' O ' ' HD1' ' A' ' 52' ' ' PHE . 4.4 tp -55.69 -24.14 15.96 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.122 0 C-N-CA 120.961 -0.296 . . . . 0.0 110.912 -179.906 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.408 HD12 ' HB3' ' A' ' 19' ' ' GLU . 0.7 OUTLIER -82.39 -33.45 28.71 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 178.523 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 24.2 m -59.21 -24.93 63.56 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.13 179.172 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.579 ' O ' ' CG ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.535 0.378 0 CA-C-O 121.139 0.495 . . . . 0.0 111.078 179.94 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.401 ' CD2' ' HB3' ' A' ' 36' ' ' ALA . 8.9 tt . . . . . 0 N--CA 1.456 -0.132 0 CA-C-O 121.003 0.43 . . . . 0.0 111.272 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . 0.442 ' HA ' ' HD3' ' A' ' 13' ' ' LYS . 1.3 ttpp -52.89 -35.32 57.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.957 -179.852 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.89 -29.15 19.84 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.872 -179.988 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.34 -37.59 87.87 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.143 179.374 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.442 ' HD3' ' HA ' ' A' ' 10' ' ' LYS . 0.0 OUTLIER -85.42 -35.49 21.26 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.96 179.712 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.432 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 0.3 OUTLIER -60.03 -44.91 94.3 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.43 0.633 . . . . 0.0 109.312 179.206 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.409 ' N ' ' HG3' ' A' ' 14' ' ' GLU . 0.9 OUTLIER -70.18 -31.05 68.34 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.531 -0.758 . . . . 0.0 109.05 177.967 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . 0.451 ' HB2' HD11 ' A' ' 33' ' ' ILE . . . -71.19 -38.32 72.09 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.221 -0.9 . . . . 0.0 111.329 -179.886 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.509 HG21 ' N ' ' A' ' 18' ' ' LYS . 1.7 tp -63.51 -34.87 70.13 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.289 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 179.338 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.509 ' N ' HG21 ' A' ' 17' ' ' ILE . 1.5 mmmp? -72.26 -32.32 66.55 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 109.082 -0.71 . . . . 0.0 109.082 177.667 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.401 ' HB2' ' HA ' ' A' ' 16' ' ' ALA . 0.5 OUTLIER -63.77 -52.72 59.08 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.22 -0.9 . . . . 0.0 111.076 179.745 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.477 ' HG ' HG12 ' A' ' 25' ' ' ILE . 0.2 OUTLIER -73.93 -35.82 64.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.212 -179.52 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.414 ' CG2' ' O ' ' A' ' 17' ' ' ILE . 33.0 t -63.29 -31.17 51.79 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-O 120.833 0.349 . . . . 0.0 110.32 179.552 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -90.04 -34.08 16.08 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.506 179.605 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -80.23 -15.12 57.71 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.534 179.723 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 46.09 94.81 0.01 OUTLIER Glycine 0 CA--C 1.522 0.471 0 C-N-CA 121.001 -0.619 . . . . 0.0 113.237 179.724 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.487 ' N ' ' CD1' ' A' ' 25' ' ' ILE . 0.1 OUTLIER -160.63 -172.15 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.333 -0.13 0 CA-C-N 116.752 0.276 . . . . 0.0 111.239 179.87 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -41.47 94.75 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.948 -179.607 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.422 ' O ' ' N ' ' A' ' 30' ' ' ILE . 0.0 OUTLIER -50.88 -25.61 4.76 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.623 179.59 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -45.89 -46.95 16.17 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-O 121.303 0.573 . . . . 0.0 110.548 179.195 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.654 ' HA ' ' HG ' ' A' ' 32' ' ' LEU . 3.0 m-85 -64.19 -29.78 70.87 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.279 0.562 . . . . 0.0 109.895 179.688 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.422 ' N ' ' O ' ' A' ' 27' ' ' GLU . 1.0 OUTLIER -62.38 -26.44 40.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.379 177.934 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -75.3 -36.05 61.19 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.403 179.373 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.654 ' HG ' ' HA ' ' A' ' 29' ' ' TYR . 0.2 OUTLIER -60.4 -34.66 74.24 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 120.263 -0.575 . . . . 0.0 109.826 179.146 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . 0.451 HD11 ' HB2' ' A' ' 16' ' ' ALA . 5.5 pt -89.99 -46.33 15.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.943 179.414 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -61.11 -29.62 69.87 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.952 -179.46 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 33.1 t30 -84.99 -20.84 29.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.017 179.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.495 ' O ' ' CB ' ' A' ' 37' ' ' LYS . . . 63.37 -140.01 0.35 Allowed 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.976 179.609 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.495 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 1.5 tpmp? 90.14 -22.38 0.11 Allowed 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 122.607 0.363 . . . . 0.0 111.221 -179.76 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -143.37 79.03 1.62 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.586 -0.279 . . . . 0.0 110.617 179.611 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.442 ' HA ' HG23 ' A' ' 42' ' ' VAL . 11.6 p -38.8 -49.05 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.445 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.767 -179.681 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.48 ' HA ' ' CD1' ' A' ' 43' ' ' TRP . 0.2 OUTLIER -59.72 -47.53 85.27 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 179.511 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -66.62 -40.25 94.02 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.412 -0.899 . . . . 0.0 112.452 179.269 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.442 HG23 ' HA ' ' A' ' 39' ' ' VAL . 21.4 t -47.07 -48.65 8.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 117.114 0.457 . . . . 0.0 110.56 179.627 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . 0.48 ' CD1' ' HA ' ' A' ' 40' ' ' GLU . 15.4 p-90 -77.27 -26.16 52.15 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.444 179.617 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.8 m -79.68 -42.16 25.33 Favored 'General case' 0 N--CA 1.462 0.167 0 C-N-CA 120.599 -0.44 . . . . 0.0 110.983 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -62.64 -33.77 75.71 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.133 -0.485 . . . . 0.0 109.846 179.405 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.461 ' O ' HG21 ' A' ' 49' ' ' ILE . 8.6 ttpt -68.89 -62.12 1.52 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.229 179.292 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -55.7 -28.79 57.58 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.343 179.752 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -80.03 -54.72 5.52 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-N 115.828 -0.623 . . . . 0.0 110.713 179.589 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.62 ' O ' ' HD1' ' A' ' 52' ' ' PHE . 7.0 tp -58.69 -23.99 24.68 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.187 0 CA-C-O 120.86 0.362 . . . . 0.0 110.856 179.839 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 2.3 tp -80.3 -33.42 37.61 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.268 -0.642 . . . . 0.0 109.268 178.375 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 29.3 m -58.21 -29.71 65.91 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.783 179.085 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.62 ' HD1' ' O ' ' A' ' 49' ' ' ILE . 0.0 OUTLIER . . . . . 0 CA--C 1.535 0.384 0 CA-C-O 120.89 0.376 . . . . 0.0 111.037 179.576 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.453 -0.307 0 CA-C-O 121.056 0.455 . . . . 0.0 110.696 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . 0.452 ' HA ' ' HD3' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -56.82 -35.29 68.61 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.017 -179.969 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.3 -38.07 16.6 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.937 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.37 -37.42 70.04 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.645 179.623 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.452 ' HD3' ' HA ' ' A' ' 10' ' ' LYS . 0.0 OUTLIER -85.19 -35.38 21.69 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.679 179.587 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.444 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 3.0 mm-40 -59.44 -50.43 73.97 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 179.059 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -63.77 -36.83 85.19 Favored 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 108.925 -0.768 . . . . 0.0 108.925 178.033 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . 0.505 ' HB2' HD13 ' A' ' 33' ' ' ILE . . . -64.21 -35.04 79.5 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-N 115.092 -0.958 . . . . 0.0 110.346 179.483 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.406 ' O ' ' CG2' ' A' ' 21' ' ' VAL . 1.4 mp -58.62 -47.44 88.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 178.965 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 4.6 mmmt -63.13 -33.12 74.77 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.936 178.59 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.43 ' HB3' HD13 ' A' ' 50' ' ' LEU . 0.2 OUTLIER -57.77 -52.49 65.25 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.873 179.618 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.461 ' HG ' ' CD1' ' A' ' 25' ' ' ILE . 0.2 OUTLIER -76.06 -30.63 58.44 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.703 -0.399 . . . . 0.0 110.37 179.77 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.406 ' CG2' ' O ' ' A' ' 17' ' ' ILE . 53.1 t -62.76 -31.28 51.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 178.733 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -86.91 -39.89 15.34 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.878 178.975 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.91 -15.05 61.15 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.795 179.033 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.419 ' C ' HG13 ' A' ' 25' ' ' ILE . . . 43.48 77.69 0.08 OUTLIER Glycine 0 C--N 1.333 0.396 0 CA-C-N 116.013 -0.539 . . . . 0.0 114.224 179.136 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.461 ' CD1' ' HG ' ' A' ' 20' ' ' LEU . 0.2 OUTLIER -141.83 -171.74 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.246 0 CA-C-O 120.734 0.302 . . . . 0.0 110.785 178.745 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.417 ' HB3' ' CE2' ' A' ' 29' ' ' TYR . . . -44.57 97.64 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.676 -179.477 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.489 ' O ' ' N ' ' A' ' 30' ' ' ILE . 10.5 pt-20 -45.85 -25.23 0.49 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.16 179.187 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -41.29 -47.61 3.47 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 121.45 0.643 . . . . 0.0 110.8 179.456 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.577 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 63.3 m-85 -59.3 -32.39 70.01 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.336 179.909 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.489 ' N ' ' O ' ' A' ' 27' ' ' GLU . 25.8 mt -62.21 -26.64 40.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.464 177.969 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 6.3 tttm -74.29 -36.1 63.75 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.61 179.662 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.577 ' HG ' ' O ' ' A' ' 29' ' ' TYR . 0.1 OUTLIER -61.51 -33.97 74.71 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 120.216 -0.594 . . . . 0.0 109.815 179.353 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . 0.505 HD13 ' HB2' ' A' ' 16' ' ' ALA . 2.4 pt -91.91 -44.71 14.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.046 179.408 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.421 ' CB ' ' O ' ' A' ' 30' ' ' ILE . . . -61.1 -30.99 70.69 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.079 -179.651 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 23.6 t30 -81.57 -3.05 52.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.114 -179.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.453 ' HA ' HG23 ' A' ' 42' ' ' VAL . . . 49.92 -131.04 1.95 Allowed 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 116.549 -0.296 . . . . 0.0 111.242 179.465 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 76.16 -5.65 2.14 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -159.9 71.41 0.47 Allowed 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 110.287 -0.264 . . . . 0.0 110.287 179.684 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.441 ' HA ' HG21 ' A' ' 42' ' ' VAL . 11.9 p -38.69 -50.63 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.906 -179.564 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -61.05 -43.28 99.12 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 109.954 -0.388 . . . . 0.0 109.954 179.321 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -66.9 -45.69 81.07 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.474 -0.869 . . . . 0.0 111.902 178.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.453 HG23 ' HA ' ' A' ' 36' ' ' ALA . 15.5 t -45.94 -39.36 3.17 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.111 0 CA-C-O 121.208 0.528 . . . . 0.0 110.352 179.141 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 45.9 t-105 -78.3 -32.06 49.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.586 179.004 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 m -77.74 -50.99 11.26 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.982 179.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.418 ' O ' HG22 ' A' ' 49' ' ' ILE . 0.9 OUTLIER -56.9 -34.51 67.98 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.314 179.543 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.512 ' O ' HG22 ' A' ' 49' ' ' ILE . 11.3 ttpp -67.52 -58.42 4.74 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.633 179.877 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 4.7 p30 -62.64 -27.43 69.21 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.362 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -79.98 -51.29 9.25 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.74 179.64 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.561 HG12 ' CB ' ' A' ' 29' ' ' TYR . 3.8 tp -57.49 -24.24 21.5 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 C-N-CA 120.741 -0.383 . . . . 0.0 110.917 179.997 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.43 HD13 ' HB3' ' A' ' 19' ' ' GLU . 2.3 tp -82.05 -35.15 29.06 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 178.89 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 10.8 m -65.22 -14.52 60.86 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 115.602 -0.726 . . . . 0.0 111.677 179.49 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.564 ' O ' ' CG ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER . . . . . 0 N--CA 1.463 0.176 0 CA-C-O 121.288 0.566 . . . . 0.0 111.551 -179.498 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.408 HD21 ' N ' ' A' ' 10' ' ' LYS . 6.8 tt . . . . . 0 N--CA 1.451 -0.395 0 CA-C-O 120.877 0.37 . . . . 0.0 111.12 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . 0.463 ' HA ' ' HD3' ' A' ' 13' ' ' LYS . 3.7 tttt -52.56 -31.54 36.46 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.628 179.904 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 13.7 tt0 -87.61 -37.73 16.55 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.565 179.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.463 ' O ' ' HB1' ' A' ' 16' ' ' ALA . . . -55.86 -38.18 69.77 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.519 179.473 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.463 ' HD3' ' HA ' ' A' ' 10' ' ' LYS . 0.0 OUTLIER -85.05 -35.31 21.96 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.6 179.692 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.45 ' O ' ' CG2' ' A' ' 17' ' ' ILE . 2.3 mm-40 -58.09 -50.04 74.85 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 178.707 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -65.13 -31.05 72.05 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 177.84 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . 0.564 ' HB2' HD13 ' A' ' 33' ' ' ILE . . . -68.22 -43.45 77.94 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 115.215 -0.902 . . . . 0.0 111.663 -179.838 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.468 HG23 ' N ' ' A' ' 18' ' ' LYS . 8.4 tp -60.31 -35.5 62.78 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.265 0 C-N-CA 120.645 -0.422 . . . . 0.0 109.875 179.933 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.468 ' N ' HG23 ' A' ' 17' ' ' ILE . 0.1 OUTLIER -72.84 -32.21 65.31 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 177.887 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.455 ' HB3' HD13 ' A' ' 50' ' ' LEU . 0.3 OUTLIER -62.2 -52.7 62.73 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.176 -0.92 . . . . 0.0 111.753 -179.797 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.495 ' HG ' HG13 ' A' ' 25' ' ' ILE . 0.2 OUTLIER -76.82 -34.45 57.9 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.878 -0.329 . . . . 0.0 110.99 -179.612 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.433 ' CG2' ' O ' ' A' ' 17' ' ' ILE . 24.1 t -61.55 -31.13 49.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 120.885 0.374 . . . . 0.0 110.199 179.386 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -90.3 -36.61 14.59 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.31 179.306 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -78.16 -14.95 59.26 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.19 179.603 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.423 ' N ' ' O ' ' A' ' 20' ' ' LEU . . . 50.47 105.3 0.01 OUTLIER Glycine 0 CA--C 1.522 0.504 0 C-N-CA 121.252 -0.499 . . . . 0.0 113.291 179.491 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.495 HG13 ' HG ' ' A' ' 20' ' ' LEU . 0.0 OUTLIER -174.76 -171.94 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.377 0 CA-C-N 117.185 0.492 . . . . 0.0 111.678 179.397 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -40.85 95.94 0.01 OUTLIER 'General case' 0 C--O 1.232 0.14 0 CA-C-N 115.911 -0.586 . . . . 0.0 112.213 -179.186 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.428 ' O ' ' N ' ' A' ' 30' ' ' ILE . 21.3 mt-10 -53.0 -25.63 12.71 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.544 179.122 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.7 tptm -46.06 -45.54 16.19 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.388 179.152 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.569 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 2.8 m-85 -61.37 -30.52 70.59 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.041 179.585 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.428 ' N ' ' O ' ' A' ' 27' ' ' GLU . 40.9 mt -62.24 -26.67 40.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 177.991 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.8 tttp -74.12 -37.13 64.19 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.629 179.386 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.569 ' HG ' ' O ' ' A' ' 29' ' ' TYR . 0.1 OUTLIER -62.38 -32.74 73.59 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 120.191 -0.604 . . . . 0.0 109.962 179.527 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . 0.564 HD13 ' HB2' ' A' ' 16' ' ' ALA . 4.0 pt -91.85 -46.3 14.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.105 179.517 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.405 ' CB ' ' O ' ' A' ' 30' ' ' ILE . . . -60.64 -30.53 69.93 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.906 -179.576 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 34.1 t30 -83.48 -14.05 53.28 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.83 179.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.484 ' O ' ' CB ' ' A' ' 37' ' ' LYS . . . 57.61 -138.74 0.88 Allowed 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.124 179.429 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.484 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 0.0 OUTLIER 89.07 -21.5 0.14 Allowed 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 122.582 0.353 . . . . 0.0 111.131 -179.54 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.5 m -143.22 78.57 1.61 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.49 179.579 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 7.8 p -40.51 -49.07 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.396 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.714 -179.642 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -60.68 -43.22 97.97 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 179.421 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -67.5 -47.88 60.21 Favored Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.55 -0.833 . . . . 0.0 111.935 179.073 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.448 ' CG1' ' HB3' ' A' ' 13' ' ' LYS . 8.8 t -43.58 -41.47 1.47 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.226 0 CA-C-O 121.188 0.518 . . . . 0.0 110.366 179.213 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 2.4 t-105 -78.38 -32.07 48.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.178 179.391 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.8 m -79.28 -48.85 13.41 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 120.782 0.325 . . . . 0.0 110.993 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.41 ' O ' HG23 ' A' ' 49' ' ' ILE . 1.8 mt -56.92 -36.87 70.71 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.056 179.569 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.488 ' O ' HG23 ' A' ' 49' ' ' ILE . 7.4 ttpt -66.65 -60.2 2.92 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.486 179.309 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -57.71 -33.23 68.2 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.574 -179.916 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -76.35 -52.71 9.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.999 179.866 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.532 HG12 ' CB ' ' A' ' 29' ' ' TYR . 9.4 tp -59.43 -24.32 27.86 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.214 -179.83 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.455 HD13 ' HB3' ' A' ' 19' ' ' GLU . 3.2 tp -79.37 -34.34 42.09 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 178.741 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 23.0 m -59.04 -35.71 73.77 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.88 179.376 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.79 ' O ' ' CG ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.54 0.568 0 CA-C-O 121.447 0.642 . . . . 0.0 110.38 179.886 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.98 0.419 . . . . 0.0 110.518 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . 0.447 ' O ' ' HB3' ' A' ' 14' ' ' GLU . 35.7 mttt -59.38 -33.72 71.54 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.832 179.868 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.421 ' O ' ' HG2' ' A' ' 14' ' ' GLU . 2.3 mp0 -88.15 -36.55 16.78 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.056 -179.86 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.427 ' O ' ' HB2' ' A' ' 16' ' ' ALA . . . -57.41 -37.23 72.42 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.84 0.352 . . . . 0.0 110.334 179.511 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.472 ' HG2' ' N ' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -84.92 -37.38 20.61 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.773 179.678 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.472 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 4.1 pt-20 -56.56 -49.37 75.03 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 109.141 -0.688 . . . . 0.0 109.141 178.875 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.441 ' N ' ' CG ' ' A' ' 14' ' ' GLU . 0.8 OUTLIER -65.01 -31.54 72.83 Favored 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 108.774 -0.824 . . . . 0.0 108.774 177.738 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . 0.553 ' HB3' HD12 ' A' ' 33' ' ' ILE . . . -65.09 -43.38 92.31 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.59 179.267 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.433 HG12 ' O ' ' A' ' 13' ' ' LYS . 37.1 mm -55.83 -48.26 78.5 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.207 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 178.771 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.6 pttt -60.98 -32.38 71.94 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.562 178.37 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -65.76 -52.35 51.71 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.701 179.496 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.55 -33.94 64.95 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.685 179.965 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.4 ' CG2' ' O ' ' A' ' 17' ' ' ILE . 54.4 t -64.64 -31.26 52.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 120.92 0.391 . . . . 0.0 110.169 179.219 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -88.77 -34.59 17.06 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.283 179.478 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -81.1 -15.22 56.55 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.313 179.505 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 41.73 82.67 0.02 OUTLIER Glycine 0 C--N 1.334 0.433 0 CA-C-N 116.216 -0.447 . . . . 0.0 113.846 179.362 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.453 ' CG2' ' CZ ' ' A' ' 52' ' ' PHE . 0.1 OUTLIER -146.38 -163.3 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.219 0 CA-C-N 116.709 0.254 . . . . 0.0 110.909 179.397 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -43.89 95.3 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 120.782 0.325 . . . . 0.0 111.85 -179.447 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.412 ' O ' ' N ' ' A' ' 30' ' ' ILE . 0.3 OUTLIER -52.18 -26.28 11.17 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.952 0.406 . . . . 0.0 110.561 179.415 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.5 tptm -46.69 -45.7 19.62 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-O 121.277 0.561 . . . . 0.0 110.319 179.135 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.574 ' HA ' ' HG ' ' A' ' 32' ' ' LEU . 3.6 m-85 -62.72 -31.01 71.85 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.878 179.558 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.412 ' N ' ' O ' ' A' ' 27' ' ' GLU . 1.6 tt -61.56 -26.51 39.8 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.627 178.322 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.03 -37.45 58.35 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.735 179.634 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.574 ' HG ' ' HA ' ' A' ' 29' ' ' TYR . 0.1 OUTLIER -60.52 -32.76 71.78 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 120.123 -0.631 . . . . 0.0 109.966 179.415 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . 0.553 HD12 ' HB3' ' A' ' 16' ' ' ALA . 3.7 pt -91.76 -47.22 14.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.923 179.442 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.402 ' CB ' ' O ' ' A' ' 30' ' ' ILE . . . -59.05 -29.23 67.15 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.999 -179.558 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 -85.72 -11.35 53.88 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.26 -179.763 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.484 ' O ' ' CB ' ' A' ' 37' ' ' LYS . . . 56.88 -141.2 0.81 Allowed 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 116.774 -0.194 . . . . 0.0 111.065 179.615 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.484 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 0.0 OUTLIER 89.45 -21.33 0.14 Allowed 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 122.629 0.372 . . . . 0.0 111.34 179.978 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 9.9 m -144.05 77.72 1.56 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.676 0.274 . . . . 0.0 110.55 179.791 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.469 ' HA ' HG21 ' A' ' 42' ' ' VAL . 14.5 p -38.85 -48.44 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.405 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.703 -179.878 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.468 ' HA ' ' CH2' ' A' ' 43' ' ' TRP . 1.8 tt0 -61.39 -52.86 62.84 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.153 179.569 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -61.79 -38.47 96.01 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.323 -0.942 . . . . 0.0 112.158 179.188 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.469 HG21 ' HA ' ' A' ' 39' ' ' VAL . 22.8 t -49.24 -45.32 17.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.938 0.399 . . . . 0.0 110.503 179.372 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . 0.468 ' CH2' ' HA ' ' A' ' 40' ' ' GLU . 1.1 p90 -79.04 -25.66 43.18 Favored 'General case' 0 N--CA 1.457 -0.121 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.028 179.308 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.422 ' N ' ' CD1' ' A' ' 43' ' ' TRP . 1.3 m -79.3 -47.53 15.7 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-O 120.885 0.374 . . . . 0.0 110.862 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -61.19 -33.54 73.62 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.01 179.527 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.466 ' O ' HG23 ' A' ' 49' ' ' ILE . 17.5 ttpt -67.85 -59.6 3.17 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.395 179.422 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.52 -32.56 70.41 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.291 179.888 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -76.35 -51.95 10.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.97 179.84 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.579 ' O ' ' CD1' ' A' ' 52' ' ' PHE . 8.6 tp -59.85 -23.86 27.79 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.243 0 C-N-CA 120.691 -0.403 . . . . 0.0 111.353 -179.804 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.2 tp -79.77 -34.62 39.63 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 178.802 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 9.3 m -67.21 -17.08 64.67 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.569 -0.741 . . . . 0.0 111.826 179.514 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.579 ' CD1' ' O ' ' A' ' 49' ' ' ILE . 0.0 OUTLIER . . . . . 0 N--CA 1.462 0.162 0 CA-C-O 121.502 0.667 . . . . 0.0 111.074 179.964 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.406 ' HB2' ' CG2' ' A' ' 39' ' ' VAL . 7.4 tt . . . . . 0 N--CA 1.455 -0.195 0 CA-C-O 120.867 0.365 . . . . 0.0 111.275 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . 0.459 ' HA ' ' HD3' ' A' ' 13' ' ' LYS . 0.8 OUTLIER -51.82 -32.6 32.31 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.745 179.962 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 2.6 tm0? -89.89 -29.14 18.75 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.879 179.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.97 -37.44 87.41 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.106 179.347 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.459 ' HD3' ' HA ' ' A' ' 10' ' ' LYS . 0.0 OUTLIER -85.27 -35.39 21.56 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.862 179.66 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.44 ' HB3' ' O ' ' A' ' 10' ' ' LYS . 0.1 OUTLIER -61.21 -47.34 86.54 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 179.218 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.409 ' N ' ' HG3' ' A' ' 14' ' ' GLU . 0.8 OUTLIER -65.76 -34.19 77.61 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 177.913 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . 0.448 ' CB ' ' HB2' ' A' ' 46' ' ' LYS . . . -68.33 -36.83 79.85 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.5 179.39 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.489 HG21 ' N ' ' A' ' 18' ' ' LYS . 1.1 tp -58.19 -35.89 55.09 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.249 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 179.286 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.489 ' N ' HG21 ' A' ' 17' ' ' ILE . 19.8 mttt -75.11 -33.07 61.56 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.654 178.347 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.424 ' HB2' ' HA ' ' A' ' 16' ' ' ALA . 0.4 OUTLIER -62.2 -52.32 64.26 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.659 179.407 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.417 ' HG ' HD11 ' A' ' 25' ' ' ILE . 0.3 OUTLIER -69.93 -34.79 73.93 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.685 179.946 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.425 ' CG2' ' O ' ' A' ' 17' ' ' ILE . 37.7 t -64.78 -31.29 53.18 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.229 0 CA-C-O 120.937 0.399 . . . . 0.0 109.933 179.091 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -84.21 -38.09 21.01 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.031 179.15 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -76.79 -15.3 59.78 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.141 179.333 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.406 ' C ' HG13 ' A' ' 25' ' ' ILE . . . 41.18 90.07 0.01 OUTLIER Glycine 0 C--N 1.335 0.495 0 CA-C-N 116.211 -0.449 . . . . 0.0 113.856 179.258 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.44 ' N ' ' CD1' ' A' ' 25' ' ' ILE . 0.0 OUTLIER -155.51 -164.71 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.271 0 CA-C-O 120.713 0.292 . . . . 0.0 110.922 179.179 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -44.75 95.76 0.01 OUTLIER 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.844 -179.586 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.43 ' O ' ' N ' ' A' ' 30' ' ' ILE . 53.2 mt-10 -48.42 -26.96 2.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.674 179.432 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 12.2 tptm -44.96 -45.45 10.53 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.504 179.274 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.602 ' HA ' ' HG ' ' A' ' 32' ' ' LEU . 75.8 m-85 -61.05 -32.52 72.15 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.422 0.629 . . . . 0.0 110.128 179.614 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.438 ' O ' HG13 ' A' ' 33' ' ' ILE . 2.2 tt -61.9 -26.38 39.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.705 178.484 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.9 tppp? -75.68 -35.6 60.31 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.576 179.472 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.602 ' HG ' ' HA ' ' A' ' 29' ' ' TYR . 0.2 OUTLIER -59.77 -35.18 74.1 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 120.361 -0.536 . . . . 0.0 109.749 179.316 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . 0.438 HG13 ' O ' ' A' ' 30' ' ' ILE . 2.9 pt -90.76 -46.33 14.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.945 179.402 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -60.51 -28.82 68.68 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.086 -179.704 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 -84.41 -12.93 53.52 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.406 -179.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.489 ' O ' ' CB ' ' A' ' 37' ' ' LYS . . . 62.7 -136.17 0.44 Allowed 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 116.86 -0.155 . . . . 0.0 110.84 179.61 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.489 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 0.0 OUTLIER 87.64 -14.86 0.42 Allowed 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 179.808 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.423 HG22 ' O ' ' A' ' 38' ' ' THR . 5.5 t -158.82 79.17 0.78 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.868 0.366 . . . . 0.0 110.635 179.388 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.406 ' CG2' ' HB2' ' A' ' 9' ' ' LEU . 10.2 p -38.65 -49.97 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.483 0 CA-C-N 115.894 -0.593 . . . . 0.0 111.753 -179.794 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -60.19 -43.09 96.19 Favored 'General case' 0 CA--C 1.52 -0.194 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 179.365 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.407 ' N ' ' O ' ' A' ' 38' ' ' THR . . . -67.66 -46.7 66.54 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.448 -0.882 . . . . 0.0 111.921 178.752 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.441 ' CG1' ' HB3' ' A' ' 13' ' ' LYS . 12.2 t -43.97 -40.99 1.65 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.197 0 CA-C-O 121.062 0.458 . . . . 0.0 110.399 179.339 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 4.6 t-105 -78.64 -32.26 47.27 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.163 179.39 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.6 m -79.14 -45.12 20.63 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.887 0.375 . . . . 0.0 110.913 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.42 ' O ' HG23 ' A' ' 49' ' ' ILE . 0.4 OUTLIER -60.06 -34.98 74.16 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.894 179.546 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.48 ' O ' HG23 ' A' ' 49' ' ' ILE . 9.7 ttpt -68.05 -61.04 2.04 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.366 179.409 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -57.03 -32.71 66.45 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.365 179.801 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -76.46 -52.82 9.09 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.811 179.772 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.553 HG12 ' CB ' ' A' ' 29' ' ' TYR . 6.2 tp -59.39 -23.86 26.45 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.32 0 C-N-CA 120.759 -0.376 . . . . 0.0 111.179 -179.895 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.414 HD11 ' HB3' ' A' ' 19' ' ' GLU . 5.4 tp -79.57 -32.54 42.04 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.19 0.519 . . . . 0.0 109.613 178.856 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 16.3 m -68.31 -20.69 64.76 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.602 -0.726 . . . . 0.0 112.049 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.614 ' O ' ' CG ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER . . . . . 0 N--CA 1.465 0.276 0 CA-C-O 121.635 0.731 . . . . 0.0 111.185 -179.74 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.412 ' CD1' ' CG2' ' A' ' 42' ' ' VAL . 1.3 tp . . . . . 0 N--CA 1.455 -0.185 0 CA-C-O 120.929 0.395 . . . . 0.0 110.815 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . 0.416 ' HA ' ' HD3' ' A' ' 13' ' ' LYS . 0.7 OUTLIER -59.39 -34.61 72.65 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.864 -179.938 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -88.5 -30.91 19.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.782 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.05 -37.75 83.75 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.085 179.321 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.499 ' O ' HG12 ' A' ' 17' ' ' ILE . 0.0 OUTLIER -85.03 -37.03 20.85 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.752 179.626 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.463 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 0.3 OUTLIER -58.45 -47.28 84.53 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 179.229 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -66.39 -33.11 74.97 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 177.837 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . 0.561 ' HB1' HD11 ' A' ' 33' ' ' ILE . . . -64.0 -36.93 85.59 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.394 179.268 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.499 HG12 ' O ' ' A' ' 13' ' ' LYS . 4.9 mm -60.94 -50.95 78.45 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.337 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 178.697 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.29 -32.2 66.39 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.355 -0.839 . . . . 0.0 109.851 178.498 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.88 -52.47 63.99 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.081 179.694 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.413 HD22 ' CD1' ' A' ' 30' ' ' ILE . 0.2 OUTLIER -79.39 -29.58 42.13 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.756 -179.984 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.416 ' CG2' ' O ' ' A' ' 17' ' ' ILE . 65.0 t -64.91 -32.43 58.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.274 179.571 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -90.0 -38.11 13.85 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.035 179.232 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -76.24 -14.72 60.12 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.023 179.283 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 48.25 97.67 0.01 OUTLIER Glycine 0 C--N 1.332 0.344 0 C-N-CA 121.143 -0.551 . . . . 0.0 113.002 179.58 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.471 HD13 HG23 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -160.11 -166.64 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.26 0 CA-C-N 116.899 0.35 . . . . 0.0 111.125 179.734 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -47.76 94.56 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.85 -179.549 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.414 ' O ' ' N ' ' A' ' 30' ' ' ILE . 4.2 mm-40 -51.24 -26.9 7.85 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.069 0.461 . . . . 0.0 110.48 179.267 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -46.8 -44.81 19.53 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.065 178.926 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.646 ' HA ' ' HG ' ' A' ' 32' ' ' LEU . 3.5 m-85 -60.76 -31.72 71.06 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.067 179.5 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.47 HG23 HD12 ' A' ' 30' ' ' ILE . 43.2 mt -61.57 -26.53 39.85 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 CA-C-N 115.967 -0.56 . . . . 0.0 109.507 178.02 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.3 tttp -74.45 -35.92 63.35 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.477 179.399 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.646 ' HG ' ' HA ' ' A' ' 29' ' ' TYR . 0.2 OUTLIER -61.36 -33.83 74.3 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 120.377 -0.529 . . . . 0.0 109.93 179.464 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . 0.561 HD11 ' HB1' ' A' ' 16' ' ' ALA . 2.3 pt -91.83 -46.65 14.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.831 179.506 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.402 ' CB ' ' O ' ' A' ' 30' ' ' ILE . . . -58.85 -29.56 67.03 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.889 -179.659 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 24.0 t30 -85.13 -7.07 59.24 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.218 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.51 ' O ' ' CB ' ' A' ' 37' ' ' LYS . . . 51.62 -138.74 1.04 Allowed 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 116.704 -0.225 . . . . 0.0 111.248 179.401 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.51 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 0.0 OUTLIER 93.1 -24.66 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 122.749 0.419 . . . . 0.0 111.072 -179.886 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.9 p -145.88 81.14 1.6 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.576 179.794 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.504 ' HA ' HG22 ' A' ' 42' ' ' VAL . 13.6 p -41.79 -47.59 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.36 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.691 -179.863 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.483 ' HA ' ' CD1' ' A' ' 43' ' ' TRP . 1.8 mt-10 -60.56 -41.83 95.37 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 179.461 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -72.21 -42.22 51.09 Favored Glycine 0 C--O 1.223 -0.589 0 C-N-CA 120.332 -0.937 . . . . 0.0 112.229 178.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.504 HG22 ' HA ' ' A' ' 39' ' ' VAL . 25.3 t -45.78 -44.75 4.75 Favored 'Isoleucine or valine' 0 C--O 1.232 0.182 0 CA-C-N 116.978 0.389 . . . . 0.0 110.927 179.583 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . 0.483 ' CD1' ' HA ' ' A' ' 40' ' ' GLU . 13.1 p-90 -79.23 -28.84 42.51 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.177 179.669 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.7 m -79.73 -36.73 36.93 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 120.487 -0.485 . . . . 0.0 110.948 179.856 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.415 ' O ' HG22 ' A' ' 49' ' ' ILE . 1.0 OUTLIER -68.14 -32.52 72.85 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.147 -0.479 . . . . 0.0 109.79 179.375 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.493 ' O ' HG22 ' A' ' 49' ' ' ILE . 8.2 ttpt -69.81 -61.53 1.74 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.273 179.263 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -57.3 -27.71 62.4 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.103 179.579 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -79.91 -53.58 6.63 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.733 179.715 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.538 HG12 ' CB ' ' A' ' 29' ' ' TYR . 6.3 tp -58.33 -24.45 24.72 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.129 0 C-N-CA 120.729 -0.388 . . . . 0.0 111.027 -179.954 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -80.91 -34.66 33.28 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 178.812 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 8.5 m -65.75 -15.69 63.08 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.699 179.483 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.624 ' O ' ' CG ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.534 0.346 0 CA-C-O 121.604 0.716 . . . . 0.0 111.241 -179.651 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.423 ' CD1' ' CG2' ' A' ' 42' ' ' VAL . 4.1 tp . . . . . 0 C--O 1.232 0.145 0 CA-C-O 120.923 0.392 . . . . 0.0 111.296 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 3.2 mtpt -57.46 -36.76 71.85 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.298 -179.636 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -85.12 -39.14 18.25 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.073 -179.798 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.74 -38.04 66.66 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.622 179.684 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.473 ' HB3' ' CG1' ' A' ' 42' ' ' VAL . 0.0 OUTLIER -85.03 -35.66 21.76 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.756 179.608 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.45 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 3.1 mm-40 -60.05 -50.52 73.4 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 179.075 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 68.8 tt0 -64.83 -31.81 73.22 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 178.038 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . 0.513 ' HA ' ' HG3' ' A' ' 46' ' ' LYS . . . -65.0 -37.78 88.78 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.175 179.194 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.458 HG12 ' O ' ' A' ' 13' ' ' LYS . 20.6 mm -58.03 -46.31 87.98 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.169 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 178.398 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.69 -32.22 73.26 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.272 -0.877 . . . . 0.0 109.47 178.237 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.432 ' HB2' ' HA ' ' A' ' 16' ' ' ALA . 0.4 OUTLIER -63.64 -52.42 60.87 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.565 179.268 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.491 ' HG ' ' CD1' ' A' ' 25' ' ' ILE . 0.3 OUTLIER -70.9 -33.98 71.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.66 179.88 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 78.1 t -63.9 -31.17 52.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.908 0.385 . . . . 0.0 110.07 179.103 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -87.08 -37.89 17.0 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.244 179.371 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.41 ' O ' HG13 ' A' ' 25' ' ' ILE . . . -77.57 -15.39 59.27 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.211 179.63 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 40.19 90.27 0.01 OUTLIER Glycine 0 C--N 1.335 0.482 0 CA-C-N 116.279 -0.419 . . . . 0.0 114.057 179.267 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.491 ' CD1' ' HG ' ' A' ' 20' ' ' LEU . 0.2 OUTLIER -162.76 -167.71 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.227 0 CA-C-N 116.839 0.32 . . . . 0.0 111.138 179.06 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -33.66 95.89 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 112.398 0.518 . . . . 0.0 112.398 -179.169 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.411 ' O ' ' N ' ' A' ' 30' ' ' ILE . 0.0 OUTLIER -56.21 -25.75 48.42 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.501 179.443 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.12 -46.1 11.65 Favored 'General case' 0 C--O 1.239 0.507 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.899 179.402 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.611 ' HA ' ' HG ' ' A' ' 32' ' ' LEU . 3.3 m-85 -64.37 -30.36 71.4 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.242 0.544 . . . . 0.0 110.242 179.848 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.411 ' N ' ' O ' ' A' ' 27' ' ' GLU . 0.9 OUTLIER -62.0 -26.39 39.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.415 178.175 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.7 ttmm -75.62 -37.83 59.43 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.55 179.484 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.611 ' HG ' ' HA ' ' A' ' 29' ' ' TYR . 0.1 OUTLIER -59.24 -33.74 71.38 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 120.102 -0.639 . . . . 0.0 109.783 179.43 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . 0.431 ' CD1' ' HB2' ' A' ' 16' ' ' ALA . 4.9 pt -90.87 -48.33 14.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.807 179.272 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -56.2 -28.89 59.92 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.886 -179.864 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -88.62 -15.95 33.7 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.946 179.755 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.468 ' O ' ' CB ' ' A' ' 37' ' ' LYS . . . 61.73 -137.7 0.51 Allowed 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.011 179.458 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.468 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 12.1 mttt 90.33 -22.86 0.1 Allowed 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 122.875 0.47 . . . . 0.0 111.23 -179.789 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -143.58 79.43 1.63 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.584 179.748 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 13.5 p -40.15 -47.72 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.595 -179.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -62.8 -43.95 97.45 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 179.427 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -66.49 -46.7 75.16 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.482 -0.866 . . . . 0.0 111.759 178.836 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.473 ' CG1' ' HB3' ' A' ' 13' ' ' LYS . 17.0 t -44.83 -41.48 2.23 Favored 'Isoleucine or valine' 0 C--O 1.234 0.248 0 CA-C-O 121.215 0.531 . . . . 0.0 110.27 179.109 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 31.7 t-105 -76.62 -31.51 57.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.957 179.098 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 m -80.53 -53.1 6.88 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.765 0.316 . . . . 0.0 110.986 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -52.86 -35.73 57.95 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.035 0.445 . . . . 0.0 109.93 179.468 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.513 ' HG3' ' HA ' ' A' ' 16' ' ' ALA . 1.2 ttmt -68.05 -59.54 3.17 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.114 179.241 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -57.71 -31.47 66.43 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.234 179.768 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -77.16 -52.59 9.0 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.891 179.795 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.571 ' O ' ' HD1' ' A' ' 52' ' ' PHE . 7.1 tp -60.78 -23.88 30.57 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-O 120.792 0.329 . . . . 0.0 111.144 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.4 ' CD2' ' HG3' ' A' ' 19' ' ' GLU . 5.4 tp -79.33 -32.95 43.5 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 178.675 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 31.6 m -61.99 -36.63 82.06 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.2 179.519 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.782 ' O ' ' CG ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.539 0.524 0 CA-C-O 121.556 0.693 . . . . 0.0 110.635 -179.882 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.424 ' CD1' ' N ' ' A' ' 10' ' ' LYS . 0.0 OUTLIER . . . . . 0 CA--C 1.53 0.183 0 CA-C-O 120.628 0.251 . . . . 0.0 111.143 . . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . 0.424 ' N ' ' CD1' ' A' ' 9' ' ' LEU . 0.0 OUTLIER -51.96 -37.25 52.21 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.933 0.397 . . . . 0.0 111.234 -179.478 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.08 -30.31 19.99 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.142 -179.794 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.19 -37.1 85.9 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.261 179.579 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.484 ' HG2' ' N ' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -85.22 -37.69 19.81 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.948 179.701 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.484 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -56.46 -45.77 80.68 Favored 'General case' 0 C--O 1.233 0.234 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 179.068 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.405 ' N ' ' HG3' ' A' ' 14' ' ' GLU . 2.0 tp10 -68.27 -33.53 74.53 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.382 -0.826 . . . . 0.0 108.876 177.859 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . 0.486 ' HB2' HD12 ' A' ' 33' ' ' ILE . . . -66.36 -37.41 85.24 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.317 179.54 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.412 HG12 ' O ' ' A' ' 13' ' ' LYS . 32.0 mm -58.81 -48.47 86.06 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.171 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 178.751 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.66 -32.86 73.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.691 178.5 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.416 ' HB3' HD11 ' A' ' 50' ' ' LEU . 0.3 OUTLIER -61.51 -52.41 64.61 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.549 -0.75 . . . . 0.0 111.06 179.861 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.421 ' CD1' HG12 ' A' ' 49' ' ' ILE . 0.2 OUTLIER -76.26 -34.91 59.15 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.951 -179.659 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.409 ' CG2' ' O ' ' A' ' 17' ' ' ILE . 71.3 t -63.42 -31.12 51.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 120.941 0.4 . . . . 0.0 110.374 179.528 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -91.49 -34.38 14.82 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.427 179.6 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -79.96 -15.17 57.82 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.323 179.791 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.407 ' O ' ' CG2' ' A' ' 25' ' ' ILE . . . 46.42 102.49 0.01 OUTLIER Glycine 0 CA--C 1.523 0.59 0 C-N-CA 121.315 -0.469 . . . . 0.0 113.334 179.476 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.434 ' CD1' ' CE1' ' A' ' 52' ' ' PHE . 1.1 pt -172.99 -173.4 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.21 0 CA-C-N 117.003 0.401 . . . . 0.0 111.326 179.501 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -36.84 95.14 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 -179.242 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.445 ' O ' ' N ' ' A' ' 30' ' ' ILE . 1.6 pt-20 -54.14 -25.48 22.55 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.732 179.47 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -44.52 -47.49 10.14 Favored 'General case' 0 C--O 1.239 0.522 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.593 179.303 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.616 ' HA ' ' HG ' ' A' ' 32' ' ' LEU . 2.1 m-85 -63.81 -30.46 71.55 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.237 0.541 . . . . 0.0 110.06 179.655 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.445 ' N ' ' O ' ' A' ' 27' ' ' GLU . 1.4 tt -60.81 -26.42 38.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.397 177.953 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.1 tptm -76.07 -37.55 58.11 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.593 179.515 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.616 ' HG ' ' HA ' ' A' ' 29' ' ' TYR . 0.1 OUTLIER -60.48 -32.42 71.41 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 119.885 -0.726 . . . . 0.0 109.856 179.349 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . 0.486 HD12 ' HB2' ' A' ' 16' ' ' ALA . 4.6 pt -91.86 -48.34 13.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.851 179.456 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -58.54 -29.35 66.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.907 -179.687 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 7.8 t-20 -85.19 -17.96 35.55 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.936 179.768 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.497 ' O ' ' CB ' ' A' ' 37' ' ' LYS . . . 61.28 -143.32 0.47 Allowed 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 116.626 -0.261 . . . . 0.0 110.923 179.612 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.497 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 0.0 OUTLIER 90.18 -21.79 0.12 Allowed 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 122.633 0.373 . . . . 0.0 111.406 -179.973 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -141.39 77.02 1.57 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.683 0.277 . . . . 0.0 110.639 179.878 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.473 ' HA ' HG21 ' A' ' 42' ' ' VAL . 12.3 p -39.38 -47.04 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.63 -179.851 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.473 ' HA ' ' CZ2' ' A' ' 43' ' ' TRP . 0.4 OUTLIER -61.16 -52.69 63.76 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 179.563 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -63.35 -37.55 95.02 Favored Glycine 0 C--O 1.226 -0.372 0 C-N-CA 120.246 -0.978 . . . . 0.0 112.186 179.234 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.473 HG21 ' HA ' ' A' ' 39' ' ' VAL . 29.1 t -49.9 -44.53 21.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 121.067 0.46 . . . . 0.0 110.387 179.416 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . 0.473 ' CZ2' ' HA ' ' A' ' 40' ' ' GLU . 1.1 p90 -81.49 -24.54 36.66 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.283 179.234 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.8 m -79.98 -48.04 14.0 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-O 120.874 0.369 . . . . 0.0 110.616 179.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 2.1 mt -62.02 -32.36 72.84 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.863 179.26 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.47 ' O ' HG22 ' A' ' 49' ' ' ILE . 4.0 tttm -67.67 -60.02 2.87 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.468 179.421 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -60.58 -30.23 69.68 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.301 179.748 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 -77.22 -52.29 9.48 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.974 179.802 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.503 HD11 ' CG ' ' A' ' 29' ' ' TYR . 7.2 tp -60.25 -24.03 29.47 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.07 -179.943 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.416 HD11 ' HB3' ' A' ' 19' ' ' GLU . 3.3 tp -79.38 -32.84 43.16 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 178.469 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 50.9 m -59.66 -37.46 78.81 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.915 179.205 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.788 ' O ' ' CG ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.539 0.549 0 CA-C-O 121.58 0.705 . . . . 0.0 110.536 179.813 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 9.2 tt . . . . . 0 N--CA 1.453 -0.29 0 CA-C-O 121.017 0.436 . . . . 0.0 110.721 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . 0.441 ' HA ' ' HD3' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -52.21 -34.0 43.62 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.738 -0.664 . . . . 0.0 110.825 179.842 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -89.3 -29.67 19.0 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.775 179.802 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.4 -38.07 88.22 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.057 179.239 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.449 ' HB3' ' CG1' ' A' ' 42' ' ' VAL . 0.0 OUTLIER -85.41 -35.45 21.3 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.037 179.704 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.436 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 0.3 OUTLIER -59.9 -42.33 93.61 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 179.128 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.403 ' N ' ' HG3' ' A' ' 14' ' ' GLU . 1.4 tp10 -72.18 -30.93 65.45 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 177.833 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . 0.492 ' HB1' HD12 ' A' ' 33' ' ' ILE . . . -68.67 -47.2 67.12 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.071 -0.968 . . . . 0.0 111.149 179.661 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.432 HG23 ' N ' ' A' ' 18' ' ' LYS . 0.5 OUTLIER -57.2 -39.24 65.95 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.235 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 179.145 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.432 ' N ' HG23 ' A' ' 17' ' ' ILE . 0.0 OUTLIER -68.09 -32.47 72.81 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 177.384 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.47 ' HB2' ' HA ' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -66.11 -49.59 66.99 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.478 179.152 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.498 ' HG ' HG12 ' A' ' 25' ' ' ILE . 0.2 OUTLIER -74.47 -35.75 63.28 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.948 -179.758 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.422 ' CG2' ' O ' ' A' ' 17' ' ' ILE . 44.0 t -63.4 -31.22 52.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 120.847 0.356 . . . . 0.0 110.21 179.461 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -89.51 -34.91 16.23 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.334 179.589 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -79.7 -14.97 58.37 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.355 179.779 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 46.33 97.39 0.01 OUTLIER Glycine 0 CA--C 1.522 0.506 0 C-N-CA 121.051 -0.595 . . . . 0.0 113.287 179.603 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.508 HG23 HD12 ' A' ' 25' ' ' ILE . 0.1 OUTLIER -162.09 -176.62 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.461 0.122 0 CA-C-N 116.884 0.342 . . . . 0.0 111.479 179.986 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -45.69 96.38 0.01 OUTLIER 'General case' 0 CA--C 1.518 -0.267 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.596 -179.452 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.507 ' O ' ' N ' ' A' ' 30' ' ' ILE . 19.5 mm-40 -45.62 -25.11 0.42 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.194 178.681 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -39.53 -50.59 2.19 Favored 'General case' 0 C--O 1.239 0.519 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.917 178.754 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.624 ' HA ' ' HG ' ' A' ' 32' ' ' LEU . 2.8 m-85 -65.47 -32.83 74.65 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.972 179.665 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.507 ' N ' ' O ' ' A' ' 27' ' ' GLU . 1.0 OUTLIER -59.76 -26.28 34.73 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.391 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.556 178.091 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.7 tttm -75.94 -37.81 58.28 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.455 179.494 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.624 ' HG ' ' HA ' ' A' ' 29' ' ' TYR . 0.1 OUTLIER -59.57 -33.03 70.92 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 120.18 -0.608 . . . . 0.0 109.766 179.308 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . 0.492 HD12 ' HB1' ' A' ' 16' ' ' ALA . 3.8 pt -91.8 -45.9 14.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.967 179.573 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -58.48 -28.8 65.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.678 -179.866 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -88.62 -12.53 42.31 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.123 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.547 ' O ' ' CB ' ' A' ' 37' ' ' LYS . . . 61.45 -140.02 0.5 Allowed 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 116.734 -0.212 . . . . 0.0 110.996 179.391 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.547 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 0.0 OUTLIER 96.33 -27.41 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 122.783 0.433 . . . . 0.0 110.758 -179.786 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -144.03 83.37 1.74 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.598 179.73 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 8.8 p -40.77 -48.18 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.464 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.475 -179.879 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.86 -43.0 99.73 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.846 -0.427 . . . . 0.0 109.846 179.304 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -66.58 -46.51 75.99 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.522 -0.847 . . . . 0.0 111.762 178.879 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.449 ' CG1' ' HB3' ' A' ' 13' ' ' LYS . 10.6 t -45.29 -41.97 2.93 Favored 'Isoleucine or valine' 0 C--O 1.233 0.201 0 CA-C-O 121.287 0.565 . . . . 0.0 110.196 179.168 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 14.3 t90 -76.76 -30.28 56.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.987 179.255 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.5 m -82.43 -54.62 5.06 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.831 0.348 . . . . 0.0 111.161 -179.782 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -52.93 -32.49 45.94 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 179.306 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.49 ' O ' HG21 ' A' ' 49' ' ' ILE . 0.3 OUTLIER -70.02 -60.77 2.09 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.271 -0.877 . . . . 0.0 110.245 179.296 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -58.25 -31.91 67.86 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.196 179.656 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -75.49 -54.98 6.14 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.836 179.763 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.553 HG12 ' CB ' ' A' ' 29' ' ' TYR . 7.7 tp -56.84 -23.88 18.71 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.188 0 C-N-CA 120.705 -0.398 . . . . 0.0 111.236 -179.85 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.403 ' CD1' ' HG3' ' A' ' 19' ' ' GLU . 4.2 tp -79.04 -34.91 43.42 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 178.931 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 17.4 m -66.06 -18.05 65.09 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.755 179.719 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.551 ' O ' ' CG ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.532 0.257 0 CA-C-O 121.467 0.651 . . . . 0.0 111.215 -179.732 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 43.9 m . . . . . 0 N--CA 1.489 1.508 0 CA-C-O 120.675 0.274 . . . . 0.0 111.382 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.4 ' HB ' ' CD1' ' A' ' 5' ' ' LEU . 0.1 OUTLIER 59.33 161.23 0.04 OUTLIER 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.867 179.967 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 7.3 t80 -107.76 26.51 10.22 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.566 -179.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -145.01 66.08 1.25 Allowed 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.869 179.82 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.4 ' CD1' ' HB ' ' A' ' 2' ' ' THR . 5.1 mp -146.5 62.79 1.21 Allowed 'General case' 0 C--O 1.235 0.325 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.813 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 3.4 pt -101.25 80.4 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.159 179.631 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 48.2 mt -131.85 137.83 48.23 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.796 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 6.1 p-10 -156.22 42.04 0.38 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.669 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.4 pp -67.67 -32.61 73.39 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.056 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 17.4 tttm -54.36 -38.32 65.95 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.146 0.498 . . . . 0.0 110.354 179.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -90.43 -32.91 16.21 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.388 179.393 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.06 -38.27 82.32 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.504 179.377 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.46 ' HG2' ' N ' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -85.41 -36.85 20.41 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.445 179.352 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.46 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 6.1 mm-40 -56.48 -50.45 71.73 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 178.906 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -64.17 -34.24 77.62 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 177.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.493 ' HB1' HD11 ' A' ' 33' ' ' ILE . . . -65.19 -38.87 91.83 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.4 179.391 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.453 HG12 ' O ' ' A' ' 13' ' ' LYS . 26.1 mm -55.62 -50.03 69.85 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.168 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 178.767 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -60.62 -33.18 72.4 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.736 -0.666 . . . . 0.0 109.964 178.642 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.74 -52.47 64.12 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.661 179.496 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.409 ' HG ' ' CD1' ' A' ' 25' ' ' ILE . 0.2 OUTLIER -76.08 -34.28 59.54 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.673 179.886 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.41 ' CG2' ' O ' ' A' ' 17' ' ' ILE . 64.1 t -64.43 -31.2 52.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-O 120.866 0.365 . . . . 0.0 110.086 179.38 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -88.24 -35.95 17.02 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.203 179.313 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.414 ' CB ' HG22 ' A' ' 53' ' ' THR . . . -78.84 -15.37 58.46 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.245 179.536 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 41.87 79.69 0.05 OUTLIER Glycine 0 CA--C 1.522 0.508 0 CA-C-N 116.307 -0.406 . . . . 0.0 113.799 179.451 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.458 ' CG2' ' CZ ' ' A' ' 52' ' ' PHE . 0.1 OUTLIER -144.2 -162.63 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.233 0 CA-C-N 116.812 0.306 . . . . 0.0 110.999 179.346 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -43.25 95.45 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.185 0 CA-C-O 120.863 0.364 . . . . 0.0 111.801 -179.497 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.414 ' O ' ' N ' ' A' ' 30' ' ' ILE . 0.4 OUTLIER -52.87 -26.03 13.48 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.576 179.504 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.96 -45.92 15.95 Favored 'General case' 0 C--O 1.237 0.445 0 CA-C-O 121.344 0.592 . . . . 0.0 110.294 179.223 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.572 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 4.0 m-85 -62.69 -31.82 72.79 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.074 179.657 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.414 ' N ' ' O ' ' A' ' 27' ' ' GLU . 1.8 tt -60.9 -26.56 39.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.0 -0.545 . . . . 0.0 109.659 178.445 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -76.62 -37.64 56.04 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.879 179.738 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.572 ' HG ' ' O ' ' A' ' 29' ' ' TYR . 0.0 OUTLIER -60.99 -32.29 71.87 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 120.034 -0.666 . . . . 0.0 109.941 179.51 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.493 HD11 ' HB1' ' A' ' 16' ' ' ALA . 3.9 pt -91.86 -45.99 14.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.017 179.365 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.38 -29.68 67.88 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.879 -179.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -87.29 -14.55 40.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.006 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.439 ' O ' ' HB2' ' A' ' 37' ' ' LYS . . . 57.75 -131.71 1.36 Allowed 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.115 179.822 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.439 ' HB2' ' O ' ' A' ' 36' ' ' ALA . 0.0 OUTLIER 85.1 -19.24 0.34 Allowed 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 122.611 0.364 . . . . 0.0 111.131 -179.737 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -147.17 77.78 1.46 Allowed 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 179.583 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 14.9 p -40.64 -49.19 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.953 -179.378 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -59.17 -42.68 91.38 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.778 -0.452 . . . . 0.0 109.778 179.373 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -69.15 -47.1 55.32 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.432 -0.889 . . . . 0.0 111.983 178.791 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.438 ' CG1' ' HB3' ' A' ' 13' ' ' LYS . 21.3 t -43.5 -41.59 1.43 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.249 0 CA-C-O 121.135 0.493 . . . . 0.0 110.538 179.322 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 39.2 t-105 -78.18 -32.16 49.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.784 -0.643 . . . . 0.0 110.988 179.512 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.8 m -78.47 -47.37 17.58 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.962 0.41 . . . . 0.0 110.992 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -58.5 -35.1 71.7 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.228 179.525 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.48 ' O ' HG21 ' A' ' 49' ' ' ILE . 1.7 ttpm? -68.12 -59.99 2.82 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.403 179.493 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.11 -31.58 69.06 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.361 179.797 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -77.42 -53.5 7.58 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 115.916 -0.583 . . . . 0.0 111.054 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.531 HG12 ' CB ' ' A' ' 29' ' ' TYR . 7.5 tp -57.01 -24.14 19.78 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.194 0 C-N-CA 120.702 -0.399 . . . . 0.0 111.203 -179.756 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 2.2 tp -80.13 -36.46 35.21 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 178.697 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 23.7 m -57.29 -24.64 56.24 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.622 178.831 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.538 ' C ' ' CD1' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -86.96 15.78 5.6 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-O 120.811 0.338 . . . . 0.0 111.042 179.647 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.519 ' CG2' ' O ' ' A' ' 53' ' ' THR . 2.5 t -152.86 55.63 0.78 Allowed 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 121.054 0.454 . . . . 0.0 110.956 179.786 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 22.8 t -127.75 106.84 15.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.408 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 66.2 p -115.26 38.46 3.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.808 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 . . . . . 0 C--O 1.248 0.975 0 CA-C-O 118.128 -0.939 . . . . 0.0 110.781 -179.89 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 3.9 p . . . . . 0 N--CA 1.492 1.647 0 CA-C-O 121.13 0.49 . . . . 0.0 110.925 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.432 ' O ' ' CG ' ' A' ' 3' ' ' TYR . 0.9 OUTLIER -153.99 -50.49 0.09 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.919 -179.999 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 0.432 ' CG ' ' O ' ' A' ' 2' ' ' THR . 30.6 p90 43.81 29.7 0.32 Allowed 'General case' 0 C--N 1.331 -0.23 0 O-C-N 123.586 0.554 . . . . 0.0 111.437 -179.532 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -171.57 -53.38 0.02 OUTLIER 'General case' 0 C--O 1.234 0.249 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.958 -179.886 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 62.85 123.68 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.645 -179.932 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 13.9 mt -112.54 95.2 3.64 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.126 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.211 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -130.53 166.23 21.02 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.48 179.772 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 10.2 p-10 -111.69 4.28 18.44 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.346 -179.825 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.6 pp -85.54 -35.16 21.29 Favored 'General case' 0 N--CA 1.455 -0.181 0 CA-C-O 120.887 0.375 . . . . 0.0 111.068 179.873 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.405 ' HA ' ' HD3' ' A' ' 13' ' ' LYS . 0.6 OUTLIER -52.22 -35.93 50.84 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.398 179.712 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 4.5 mt-30 -90.51 -32.52 16.3 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.467 179.442 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.432 ' O ' ' HB3' ' A' ' 16' ' ' ALA . . . -60.81 -37.75 83.05 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.371 179.451 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.468 ' HG2' ' N ' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -85.46 -37.47 19.71 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.419 179.466 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.468 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 5.8 mm-40 -57.77 -50.45 73.22 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 179.173 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -65.27 -32.46 74.13 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 177.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.482 ' HB1' HD13 ' A' ' 33' ' ' ILE . . . -66.97 -37.5 84.36 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.42 179.437 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.455 HG12 ' O ' ' A' ' 13' ' ' LYS . 21.0 mm -57.45 -48.21 83.3 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.14 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 178.713 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 18.4 mttt -63.59 -33.3 75.31 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.822 178.568 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.446 ' HB2' ' HA ' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -59.96 -52.24 66.24 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.692 179.53 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.452 ' HG ' HD13 ' A' ' 25' ' ' ILE . 0.3 OUTLIER -75.86 -32.41 59.73 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.747 -179.852 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.414 ' CG2' ' O ' ' A' ' 17' ' ' ILE . 53.9 t -64.3 -31.25 52.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.252 179.408 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -90.32 -38.3 13.46 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.436 179.591 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.442 ' O ' HG13 ' A' ' 25' ' ' ILE . . . -78.77 -15.55 58.28 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.438 179.797 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 40.58 90.04 0.01 OUTLIER Glycine 0 C--N 1.335 0.515 0 CA-C-N 116.344 -0.389 . . . . 0.0 113.739 179.381 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.452 HD13 ' HG ' ' A' ' 20' ' ' LEU . 0.4 OUTLIER -176.2 136.2 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.227 0 CA-C-O 121.072 0.463 . . . . 0.0 111.707 179.445 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . 38.11 89.97 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 115.616 -0.72 . . . . 0.0 112.558 179.696 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.82 -29.38 70.69 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.283 0.563 . . . . 0.0 109.637 178.557 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 2.6 tptt -46.08 -45.19 16.07 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.481 179.11 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.565 ' HA ' ' HG ' ' A' ' 32' ' ' LEU . 3.6 m-85 -64.0 -31.63 72.88 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.085 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 1.6 tt -60.94 -26.19 38.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.732 178.322 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 12.7 tttt -77.89 -37.58 47.67 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.057 179.729 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.565 ' HG ' ' HA ' ' A' ' 29' ' ' TYR . 0.0 OUTLIER -60.69 -32.07 71.31 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 120.214 -0.594 . . . . 0.0 109.839 179.688 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.482 HD13 ' HB1' ' A' ' 16' ' ' ALA . 5.0 pt -91.7 -45.83 14.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.986 179.47 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -60.35 -29.09 68.67 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.003 -179.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 -86.47 -15.8 39.04 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.253 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.527 ' O ' ' CB ' ' A' ' 37' ' ' LYS . . . 59.22 -139.4 0.72 Allowed 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 116.662 -0.245 . . . . 0.0 110.893 179.634 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.527 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 1.4 tptt 94.81 -26.71 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 122.688 0.395 . . . . 0.0 110.855 -179.691 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.2 m -142.95 82.45 1.76 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.461 179.588 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 11.5 p -41.29 -47.66 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.568 -179.484 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -60.39 -43.92 96.15 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.877 -0.416 . . . . 0.0 109.877 179.292 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -67.91 -47.23 61.61 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 120.424 -0.893 . . . . 0.0 111.948 178.815 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.459 ' CG1' ' HB3' ' A' ' 13' ' ' LYS . 21.9 t -43.72 -41.52 1.56 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.259 0 CA-C-O 121.177 0.513 . . . . 0.0 110.584 179.195 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 37.0 t90 -78.59 -30.88 46.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.086 179.497 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.8 m -78.88 -44.93 21.74 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 120.722 0.296 . . . . 0.0 111.105 -179.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 1.2 mt -61.86 -34.13 75.43 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.044 179.572 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.497 ' O ' HG22 ' A' ' 49' ' ' ILE . 1.2 ttpt -68.38 -60.72 2.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.473 179.539 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -58.08 -30.51 66.28 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.247 179.713 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.61 -54.0 6.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.922 179.769 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.506 HG12 ' CB ' ' A' ' 29' ' ' TYR . 5.3 tp -57.67 -24.06 21.68 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.141 0 C-N-CA 120.9 -0.32 . . . . 0.0 111.193 -179.892 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 4.3 tp -80.29 -35.86 35.21 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 178.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 17.3 m -66.26 -15.91 63.59 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.788 179.695 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.537 ' O ' ' CG ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -91.55 27.14 2.08 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-O 121.158 0.504 . . . . 0.0 111.509 -179.478 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.435 ' OG1' ' O ' ' A' ' 52' ' ' PHE . 4.6 m -177.06 70.46 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.591 179.178 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 34.2 t -132.15 122.36 48.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.939 -179.492 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -127.43 106.39 9.16 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.821 179.786 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 . . . . . 0 C--O 1.246 0.882 0 CA-C-O 118.315 -0.85 . . . . 0.0 110.985 -179.984 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 12.0 t . . . . . 0 N--CA 1.48 1.037 0 CA-C-O 120.902 0.382 . . . . 0.0 111.405 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 5.7 p -159.07 -53.03 0.06 Allowed 'General case' 0 N--CA 1.451 -0.405 0 CA-C-O 120.905 0.384 . . . . 0.0 110.979 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 60.92 19.46 9.79 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.909 0.385 . . . . 0.0 110.834 179.475 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -154.1 77.65 1.09 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.646 -0.252 . . . . 0.0 111.11 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -168.05 93.68 0.38 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.881 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 4.6 pt -129.42 -47.84 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.258 179.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 2.2 pp 169.64 163.87 0.06 Allowed 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 120.968 0.413 . . . . 0.0 110.935 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -150.81 35.78 0.62 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.026 179.556 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.6 pp -85.38 -32.45 22.39 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.073 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.415 ' HA ' ' HD3' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -50.85 -37.91 46.01 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.092 0.473 . . . . 0.0 110.627 -179.958 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.0 -32.77 16.62 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.536 179.787 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.91 -37.52 82.56 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.498 179.46 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.473 ' HG2' ' N ' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -85.35 -37.54 19.79 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.477 179.371 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.473 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 2.8 mm-40 -56.86 -50.56 72.1 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 178.947 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -64.33 -34.69 78.74 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 177.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.432 ' HB2' HD13 ' A' ' 33' ' ' ILE . . . -64.46 -37.98 89.41 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.225 179.286 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.466 HG12 ' O ' ' A' ' 13' ' ' LYS . 23.6 mm -56.3 -47.53 81.0 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.158 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 178.689 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 18.2 mttp -62.86 -33.27 74.92 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.912 178.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -61.42 -52.31 65.12 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.636 179.549 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.499 ' HG ' HD12 ' A' ' 25' ' ' ILE . 0.2 OUTLIER -72.51 -35.03 68.02 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.772 -179.963 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.41 ' CG2' ' O ' ' A' ' 17' ' ' ILE . 70.2 t -63.27 -31.17 51.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 120.809 0.338 . . . . 0.0 110.244 179.36 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -88.86 -36.09 16.18 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.463 179.508 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -78.32 -15.42 58.74 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.341 179.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.41 ' C ' HG13 ' A' ' 25' ' ' ILE . . . 41.34 90.43 0.01 OUTLIER Glycine 0 CA--C 1.524 0.612 0 C-N-CA 121.507 -0.378 . . . . 0.0 113.792 179.44 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.499 HD12 ' HG ' ' A' ' 20' ' ' LEU . 0.0 OUTLIER -156.32 -163.54 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 CA-C-N 116.649 0.224 . . . . 0.0 110.915 179.387 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -45.17 95.07 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 120.823 0.344 . . . . 0.0 111.699 -179.613 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.434 ' O ' ' N ' ' A' ' 30' ' ' ILE . 7.8 mt-10 -52.24 -25.64 9.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.778 179.455 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -45.38 -46.81 13.42 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.593 179.402 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.621 ' HA ' ' HG ' ' A' ' 32' ' ' LEU . 1.1 m-85 -62.46 -30.42 71.23 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.283 0.563 . . . . 0.0 109.919 179.706 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.434 ' N ' ' O ' ' A' ' 27' ' ' GLU . 1.3 tt -60.81 -26.25 37.91 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.361 0 CA-C-N 115.778 -0.646 . . . . 0.0 109.361 177.941 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.42 -37.2 57.41 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.64 179.607 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.621 ' HG ' ' HA ' ' A' ' 29' ' ' TYR . 0.1 OUTLIER -59.82 -33.89 72.35 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 120.068 -0.653 . . . . 0.0 109.813 179.359 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.432 HD13 ' HB2' ' A' ' 16' ' ' ALA . 4.2 pt -90.78 -46.71 14.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.966 179.541 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -57.6 -28.64 63.81 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.774 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 16.6 t-20 -89.43 -15.72 32.54 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.944 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.492 ' O ' ' CB ' ' A' ' 37' ' ' LYS . . . 59.08 -134.95 0.89 Allowed 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 116.67 -0.241 . . . . 0.0 110.964 179.633 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.492 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 5.6 ttmm 89.98 -22.61 0.11 Allowed 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 122.699 0.4 . . . . 0.0 111.145 -179.894 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.2 m -145.67 79.0 1.56 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.396 179.675 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.413 ' HA ' HG23 ' A' ' 42' ' ' VAL . 10.0 p -39.54 -48.54 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.426 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.641 -179.63 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.469 ' HA ' ' CZ2' ' A' ' 43' ' ' TRP . 3.1 mt-10 -58.08 -45.72 86.66 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 179.369 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -69.13 -43.59 71.09 Favored Glycine 0 N--CA 1.447 -0.594 0 C-N-CA 120.408 -0.901 . . . . 0.0 112.182 178.844 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.432 ' CG1' ' HB3' ' A' ' 13' ' ' LYS . 23.7 t -43.27 -46.69 1.49 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.175 0 CA-C-O 120.879 0.371 . . . . 0.0 110.834 179.696 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . 0.469 ' CZ2' ' HA ' ' A' ' 40' ' ' GLU . 1.1 p90 -78.47 -27.52 46.33 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 120.612 -0.435 . . . . 0.0 110.979 179.277 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.434 ' N ' ' CD1' ' A' ' 43' ' ' TRP . 3.2 m -76.62 -49.28 16.64 Favored 'General case' 0 N--CA 1.463 0.184 0 C-N-CA 120.75 -0.38 . . . . 0.0 110.839 179.825 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 3.6 mt -59.79 -33.07 71.23 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.224 179.585 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.478 ' O ' HG23 ' A' ' 49' ' ' ILE . 6.7 ttpt -67.97 -59.0 3.6 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.359 179.562 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -60.66 -31.71 70.92 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.241 179.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -76.23 -52.64 9.61 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.931 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.507 ' O ' ' CD1' ' A' ' 52' ' ' PHE . 7.4 tp -58.43 -23.97 23.83 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.257 0 C-N-CA 120.784 -0.367 . . . . 0.0 111.16 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 1.5 tp -79.24 -34.94 42.3 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 178.549 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 34.3 m -61.26 -24.32 66.3 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.313 179.238 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.515 ' C ' ' CD1' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -88.38 22.31 2.56 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 120.914 0.388 . . . . 0.0 111.179 -179.88 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.456 ' CG2' ' O ' ' A' ' 53' ' ' THR . 4.5 t -149.22 54.58 0.97 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.117 0.484 . . . . 0.0 111.246 179.662 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 41.9 t -147.85 -78.87 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.26 179.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -159.63 -166.79 1.84 Allowed 'General case' 0 N--CA 1.454 -0.265 0 CA-C-O 120.97 0.414 . . . . 0.0 110.942 179.63 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 12.9 tt0 . . . . . 0 C--O 1.248 0.984 0 CA-C-O 118.401 -0.809 . . . . 0.0 110.99 179.846 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 28.5 p . . . . . 0 N--CA 1.487 1.393 0 CA-C-O 120.924 0.392 . . . . 0.0 111.018 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 3.6 p -141.08 145.59 36.03 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.041 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 0.49 ' HB2' ' CD1' ' A' ' 5' ' ' LEU . 13.0 p90 -112.87 -39.03 4.36 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.29 179.823 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 58.38 68.34 0.84 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.318 179.772 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.49 ' CD1' ' HB2' ' A' ' 3' ' ' TYR . 5.2 mp -135.14 178.0 7.37 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.182 0.515 . . . . 0.0 110.89 -179.873 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 5.2 mt -106.63 71.23 0.3 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.234 0 CA-C-O 121.101 0.477 . . . . 0.0 111.084 -179.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -109.23 147.27 32.84 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.623 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -162.35 51.12 0.2 Allowed 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.167 -179.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.0 pp -77.11 -34.28 56.81 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.909 0.385 . . . . 0.0 110.627 179.683 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.42 ' HA ' ' HD3' ' A' ' 13' ' ' LYS . 0.7 OUTLIER -53.61 -37.8 63.38 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.247 179.55 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -89.88 -32.64 16.78 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.347 179.441 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.88 -38.28 81.76 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.321 179.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.431 ' HG2' ' N ' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -85.46 -35.16 21.4 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.636 179.394 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.457 ' O ' HG23 ' A' ' 17' ' ' ILE . 2.1 mm-40 -60.43 -50.44 73.57 Favored 'General case' 0 C--O 1.234 0.263 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 179.049 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -64.41 -34.49 78.3 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 178.026 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.449 ' CB ' ' HB2' ' A' ' 46' ' ' LYS . . . -67.26 -36.34 81.4 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 115.177 -0.919 . . . . 0.0 110.436 179.587 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.502 HG23 ' N ' ' A' ' 18' ' ' LYS . 1.8 tp -59.9 -33.55 53.06 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.209 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 179.18 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.502 ' N ' HG23 ' A' ' 17' ' ' ILE . 4.5 mttp -76.7 -33.21 58.23 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.583 178.348 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.42 ' HB3' HD11 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -59.05 -52.44 65.72 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.677 179.419 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.491 ' HG ' ' CD1' ' A' ' 25' ' ' ILE . 0.3 OUTLIER -71.41 -35.86 71.13 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.895 -179.842 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.42 ' CG2' ' O ' ' A' ' 17' ' ' ILE . 41.1 t -62.33 -31.28 51.18 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-O 120.982 0.42 . . . . 0.0 110.119 179.28 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -88.58 -35.27 16.99 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.96 179.14 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.41 ' CB ' HG21 ' A' ' 53' ' ' THR . . . -77.12 -15.19 59.64 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.17 179.45 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 39.66 85.93 0.01 OUTLIER Glycine 0 CA--C 1.521 0.449 0 CA-C-N 116.235 -0.439 . . . . 0.0 113.905 179.358 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.491 ' CD1' ' HG ' ' A' ' 20' ' ' LEU . 0.8 OUTLIER -163.41 -171.18 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 CA-C-N 116.716 0.258 . . . . 0.0 111.118 179.15 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -28.78 95.73 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -179.096 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.446 ' O ' ' N ' ' A' ' 30' ' ' ILE . 0.3 OUTLIER -58.96 -25.54 63.65 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.464 179.46 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -44.15 -46.6 8.84 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.681 179.473 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.603 ' HA ' ' HG ' ' A' ' 32' ' ' LEU . 3.5 m-85 -62.39 -31.24 71.88 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.291 0.567 . . . . 0.0 110.169 179.743 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.446 ' N ' ' O ' ' A' ' 27' ' ' GLU . 1.9 tt -60.79 -26.28 37.94 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.485 178.149 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 13.9 tttt -76.54 -37.13 57.14 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.704 179.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.603 ' HG ' ' HA ' ' A' ' 29' ' ' TYR . 0.1 OUTLIER -60.73 -32.67 71.93 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 120.095 -0.642 . . . . 0.0 109.834 179.494 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.438 HD13 ' HB3' ' A' ' 16' ' ' ALA . 5.1 pt -91.5 -45.62 14.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.966 179.444 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.56 -28.94 67.56 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.868 -179.823 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 20.6 t30 -87.97 -14.37 39.34 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.174 -179.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.533 ' O ' ' CB ' ' A' ' 37' ' ' LYS . . . 57.28 -139.42 0.88 Allowed 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 116.738 -0.21 . . . . 0.0 111.085 179.553 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.533 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 0.9 OUTLIER 95.44 -27.38 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 122.843 0.457 . . . . 0.0 110.734 -179.752 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -142.25 82.89 1.81 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.3 179.564 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 14.8 p -41.83 -47.21 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.307 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.658 -179.64 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.2 -43.29 96.04 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 179.254 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -68.87 -46.96 58.04 Favored Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.481 -0.866 . . . . 0.0 112.008 178.791 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.425 ' CG1' ' HB3' ' A' ' 13' ' ' LYS . 21.7 t -43.88 -41.88 1.7 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-O 121.135 0.493 . . . . 0.0 110.518 179.18 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 64.1 t-105 -77.71 -31.69 52.45 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.094 179.438 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.8 m -78.61 -44.6 23.56 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 120.748 0.309 . . . . 0.0 111.085 -179.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -60.58 -35.07 75.19 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.083 179.479 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.485 ' O ' HG23 ' A' ' 49' ' ' ILE . 0.8 OUTLIER -68.24 -60.38 2.51 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.459 179.554 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -59.47 -29.73 68.03 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.322 179.739 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -78.14 -54.24 6.47 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.974 179.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.598 ' O ' ' HD2' ' A' ' 52' ' ' PHE . 8.6 tp -56.1 -24.32 17.48 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 C-N-CA 120.828 -0.349 . . . . 0.0 111.061 -179.735 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.42 HD11 ' HB3' ' A' ' 19' ' ' GLU . 1.2 tp -81.07 -35.7 31.4 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 178.526 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 7.5 m -55.58 -27.37 48.87 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.244 178.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.598 ' HD2' ' O ' ' A' ' 49' ' ' ILE . 0.0 OUTLIER -78.33 1.75 20.8 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-O 120.874 0.369 . . . . 0.0 110.27 178.836 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.458 ' CG2' ' O ' ' A' ' 53' ' ' THR . 2.1 t -145.39 50.7 1.21 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.253 179.243 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 34.0 m -134.11 -174.26 1.15 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.274 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.016 -179.436 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.9 m 64.4 115.83 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.118 0 CA-C-O 121.134 0.492 . . . . 0.0 110.697 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.247 0.961 0 CA-C-O 118.158 -0.925 . . . . 0.0 110.994 179.763 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' THR . . . . . 0.409 ' O ' ' N ' ' A' ' 3' ' ' TYR . 24.9 p . . . . . 0 N--CA 1.493 1.677 0 CA-C-O 120.602 0.239 . . . . 0.0 110.827 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.8 p 51.7 -87.35 0.01 OUTLIER 'General case' 0 C--O 1.236 0.372 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.385 179.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 0.409 ' N ' ' O ' ' A' ' 1' ' ' THR . 19.5 t80 56.45 34.29 24.01 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.723 0.297 . . . . 0.0 110.82 179.803 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.66 86.15 1.52 Allowed 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.086 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -136.91 124.8 22.65 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.915 179.879 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 2.6 pt -102.08 33.69 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.336 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -155.89 121.21 4.84 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.83 -179.86 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 -162.42 50.11 0.18 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.869 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.401 ' HB3' ' HA ' ' A' ' 39' ' ' VAL . 3.1 pp -83.89 -32.53 25.13 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.912 -179.923 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 7.7 tttm -52.03 -38.84 58.33 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.032 0.444 . . . . 0.0 110.514 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.28 -33.2 18.13 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.445 179.553 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.64 -37.54 78.94 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.584 179.465 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.453 ' HG2' ' N ' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -85.42 -35.97 20.96 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.526 179.425 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.453 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 23.9 mt-10 -57.04 -50.41 72.84 Favored 'General case' 0 C--O 1.237 0.403 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 178.915 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -63.96 -33.89 76.75 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 177.666 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.501 ' HB2' HD13 ' A' ' 33' ' ' ILE . . . -64.55 -38.49 91.18 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.205 179.246 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.442 HG12 ' O ' ' A' ' 13' ' ' LYS . 26.7 mm -56.12 -52.49 50.01 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.13 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 178.823 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.38 -33.06 70.73 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.845 178.58 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.424 ' HB3' HD13 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -59.95 -52.24 66.23 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.382 179.324 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.488 ' HG ' ' CD1' ' A' ' 25' ' ' ILE . 0.3 OUTLIER -72.74 -32.31 65.58 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.418 179.748 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 87.9 t -62.6 -32.11 54.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 120.904 0.383 . . . . 0.0 110.276 179.328 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.4 ' OD2' ' HA ' ' A' ' 19' ' ' GLU . 1.5 p30 -88.19 -40.12 13.95 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.28 179.412 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.32 -15.28 60.96 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.178 179.424 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.412 ' C ' HG13 ' A' ' 25' ' ' ILE . . . 37.57 89.55 0.01 OUTLIER Glycine 0 CA--C 1.522 0.525 0 CA-C-N 116.121 -0.491 . . . . 0.0 114.036 179.296 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.488 ' CD1' ' HG ' ' A' ' 20' ' ' LEU . 0.5 OUTLIER -159.08 -168.83 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.214 0 CA-C-N 116.653 0.227 . . . . 0.0 111.058 179.285 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -33.47 95.73 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -179.269 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.429 ' O ' ' N ' ' A' ' 30' ' ' ILE . 1.3 mp0 -54.41 -25.68 26.16 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.562 179.562 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.4 tptt -44.57 -46.37 9.94 Favored 'General case' 0 C--O 1.238 0.489 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.608 179.519 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.565 ' HA ' ' HG ' ' A' ' 32' ' ' LEU . 3.3 m-85 -62.97 -31.66 72.82 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.189 0.518 . . . . 0.0 110.209 179.819 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.429 ' N ' ' O ' ' A' ' 27' ' ' GLU . 2.0 tt -60.61 -26.17 37.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.683 178.347 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 7.1 tptt -77.44 -37.67 51.13 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.884 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.565 ' HG ' ' HA ' ' A' ' 29' ' ' TYR . 0.0 OUTLIER -60.96 -31.88 71.43 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 120.044 -0.662 . . . . 0.0 110.027 179.583 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.501 HD13 ' HB2' ' A' ' 16' ' ' ALA . 3.2 pt -91.72 -46.05 14.4 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.938 179.371 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -58.75 -28.87 66.31 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.953 -179.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 16.6 t-20 -89.12 -13.54 38.27 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.058 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.529 ' O ' ' CB ' ' A' ' 37' ' ' LYS . . . 58.14 -136.32 0.95 Allowed 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 116.69 -0.232 . . . . 0.0 111.054 179.643 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.529 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 24.2 tttt 94.8 -26.86 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 122.767 0.427 . . . . 0.0 110.718 -179.701 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -144.4 83.17 1.71 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.31 179.673 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.401 ' HA ' ' HB3' ' A' ' 9' ' ' LEU . 12.9 p -41.34 -47.52 0.79 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.651 -179.598 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -60.6 -43.27 97.61 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 179.194 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -67.75 -46.52 67.27 Favored Glycine 0 N--CA 1.448 -0.567 0 C-N-CA 120.526 -0.845 . . . . 0.0 111.884 178.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.423 ' CG1' ' HB3' ' A' ' 13' ' ' LYS . 20.7 t -45.19 -39.63 2.25 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 CA-C-O 121.171 0.51 . . . . 0.0 110.494 179.281 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 1.9 t90 -79.56 -30.41 41.67 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.87 179.336 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.7 m -78.93 -48.25 14.92 Favored 'General case' 0 C--N 1.334 -0.084 0 CA-C-O 120.892 0.377 . . . . 0.0 110.836 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 1.5 mt -59.3 -34.7 72.62 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.145 179.564 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.506 ' O ' HG22 ' A' ' 49' ' ' ILE . 3.5 ttpp -68.51 -59.02 3.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.416 179.495 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.02 -30.1 67.76 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.223 179.676 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -78.04 -54.32 6.41 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.847 179.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.558 ' O ' ' HD1' ' A' ' 52' ' ' PHE . 4.1 tp -56.6 -23.93 18.15 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.208 0 C-N-CA 120.858 -0.337 . . . . 0.0 110.923 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.424 HD13 ' HB3' ' A' ' 19' ' ' GLU . 3.4 tp -80.74 -33.52 35.06 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 178.525 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 38.1 m -60.13 -26.34 66.19 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.617 -0.72 . . . . 0.0 111.199 179.462 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.759 ' O ' ' CG ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -86.06 44.17 1.11 Allowed 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 121.466 0.651 . . . . 0.0 111.01 -179.803 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.508 ' O ' ' CG1' ' A' ' 54' ' ' VAL . 1.2 m 169.22 -64.5 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 115.914 -0.585 . . . . 0.0 109.693 179.614 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.51 ' O ' ' N ' ' A' ' 56' ' ' GLU . 9.9 p 53.24 160.79 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.455 -0.183 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.933 179.707 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 35.3 p 51.57 -81.5 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.424 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.51 ' N ' ' O ' ' A' ' 54' ' ' VAL . 6.2 mm-40 . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.252 -0.88 . . . . 0.0 110.82 -179.781 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 10.3 t . . . . . 0 N--CA 1.488 1.45 0 CA-C-O 120.844 0.354 . . . . 0.0 111.195 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -152.59 139.58 19.15 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.236 0.541 . . . . 0.0 110.775 -179.736 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 12.1 t80 -80.28 -19.22 47.24 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.415 179.614 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 5.6 ttpt 68.68 60.93 0.36 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.057 0.456 . . . . 0.0 110.629 179.698 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.5 mt -102.88 78.44 1.67 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.67 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 4.2 mt 66.11 119.37 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.756 179.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 2.4 mm? 63.45 116.92 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.942 179.673 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 3.3 t30 -169.09 57.94 0.05 OUTLIER 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.592 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.1 pp -77.13 -32.51 56.49 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.977 -179.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.419 ' O ' ' HB3' ' A' ' 14' ' ' GLU . 12.4 tttp -50.66 -37.38 40.54 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.571 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -89.97 -29.26 18.58 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.703 179.705 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.99 -38.25 90.41 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.172 179.298 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.433 ' HG2' ' N ' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -85.6 -35.26 21.13 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.06 179.725 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.433 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 0.4 OUTLIER -59.15 -43.96 92.07 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.58 0.705 . . . . 0.0 109.238 179.035 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.402 ' N ' ' HG3' ' A' ' 14' ' ' GLU . 3.9 tp10 -70.75 -31.08 67.76 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.442 -0.799 . . . . 0.0 108.973 177.941 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.451 ' HA ' ' HG3' ' A' ' 46' ' ' LYS . . . -70.42 -41.82 72.42 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 115.217 -0.901 . . . . 0.0 111.307 -179.743 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.494 HG23 ' N ' ' A' ' 18' ' ' LYS . 0.8 OUTLIER -60.09 -35.51 61.91 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.285 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 179.305 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.494 ' N ' HG23 ' A' ' 17' ' ' ILE . 0.2 OUTLIER -70.48 -32.5 70.04 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 108.979 -0.749 . . . . 0.0 108.979 177.54 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.429 ' HB2' ' HA ' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -63.44 -52.53 61.08 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.16 -0.927 . . . . 0.0 111.266 179.801 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.461 ' HG ' HG13 ' A' ' 25' ' ' ILE . 0.2 OUTLIER -77.45 -35.18 54.16 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.192 -179.461 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.426 ' CG2' ' O ' ' A' ' 17' ' ' ILE . 37.1 t -65.22 -31.01 52.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 120.883 0.373 . . . . 0.0 110.298 179.57 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 23.2 m-20 -91.12 -33.18 15.56 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.7 179.747 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.419 ' HB2' HG21 ' A' ' 53' ' ' THR . . . -83.8 -14.96 50.13 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.526 179.863 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.425 ' C ' ' CG1' ' A' ' 25' ' ' ILE . . . 55.18 112.46 0.01 OUTLIER Glycine 0 CA--C 1.523 0.586 0 C-N-CA 121.071 -0.585 . . . . 0.0 112.951 179.481 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.461 HG13 ' HG ' ' A' ' 20' ' ' LEU . 0.0 OUTLIER -178.82 -173.69 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.357 0 CA-C-N 117.165 0.482 . . . . 0.0 111.407 179.478 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -43.77 94.56 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.133 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.832 -179.421 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.409 ' O ' ' N ' ' A' ' 30' ' ' ILE . 3.0 mt-10 -50.86 -26.74 6.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.528 179.347 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -46.67 -46.33 19.9 Favored 'General case' 0 C--O 1.238 0.483 0 CA-C-O 121.325 0.584 . . . . 0.0 110.211 179.055 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.621 ' HA ' ' HG ' ' A' ' 32' ' ' LEU . 3.0 m-85 -62.08 -32.13 72.64 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 121.41 0.624 . . . . 0.0 109.767 179.413 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.438 ' O ' HG13 ' A' ' 33' ' ' ILE . 1.2 tt -60.59 -26.25 37.2 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.659 178.31 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.4 ttpt -76.2 -36.56 58.56 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.606 179.471 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.621 ' HG ' ' HA ' ' A' ' 29' ' ' TYR . 0.2 OUTLIER -59.73 -34.03 72.4 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 120.394 -0.523 . . . . 0.0 109.76 179.188 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.451 HD11 ' HB2' ' A' ' 16' ' ' ALA . 2.9 pt -91.82 -45.56 14.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.959 179.6 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.67 -29.41 68.04 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.771 -179.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 30.7 t30 -87.39 -12.68 45.55 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.031 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.52 ' O ' ' CB ' ' A' ' 37' ' ' LYS . . . 59.28 -134.31 0.9 Allowed 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.062 179.675 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.52 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 1.0 OUTLIER 92.9 -40.59 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 122.79 0.436 . . . . 0.0 110.537 -179.686 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 13.8 p -129.97 82.47 2.07 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.25 179.476 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 12.6 p -41.69 -49.14 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.358 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.772 -179.63 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -58.34 -41.83 85.52 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 179.168 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -68.96 -47.67 53.03 Favored Glycine 0 N--CA 1.448 -0.554 0 C-N-CA 120.609 -0.805 . . . . 0.0 111.982 178.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.419 ' CG1' ' HB3' ' A' ' 13' ' ' LYS . 17.4 t -42.84 -40.78 1.04 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.192 0 CA-C-O 121.191 0.52 . . . . 0.0 110.493 179.23 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 68.0 t-105 -79.21 -32.89 44.12 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.199 179.342 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.6 m -79.79 -49.62 11.75 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-O 120.997 0.427 . . . . 0.0 111.021 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.405 ' O ' HG21 ' A' ' 49' ' ' ILE . 0.4 OUTLIER -56.81 -34.97 68.21 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.033 179.428 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.494 ' O ' HG21 ' A' ' 49' ' ' ILE . 3.5 tttm -68.54 -60.21 2.59 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.4 179.341 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -57.98 -32.27 67.73 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.415 179.714 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -76.18 -53.49 8.2 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.08 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.535 HG12 ' CB ' ' A' ' 29' ' ' TYR . 7.3 tp -57.38 -24.28 21.24 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.171 0 C-N-CA 120.649 -0.42 . . . . 0.0 111.265 -179.777 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 2.2 tp -79.24 -35.84 40.91 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 178.794 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 44.1 m -59.31 -25.44 64.16 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.011 178.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.544 ' O ' ' CG ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -89.05 17.86 5.45 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-O 120.924 0.392 . . . . 0.0 111.042 -179.992 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.479 ' O ' HG22 ' A' ' 53' ' ' THR . 10.6 t -148.31 58.4 1.08 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.136 0.493 . . . . 0.0 111.357 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 9.9 p -151.81 142.73 15.86 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.314 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.315 179.504 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.36 -69.33 0.24 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.983 -179.765 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.453 -0.784 . . . . 0.0 111.445 179.594 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 1.3 m . . . . . 0 N--CA 1.489 1.51 0 CA-C-O 120.69 0.281 . . . . 0.0 111.274 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 1.6 p -122.86 -44.93 2.18 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.043 179.734 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 61.79 17.09 8.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.141 -179.923 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -171.25 93.83 0.17 Allowed 'General case' 0 CA--C 1.522 -0.101 0 CA-C-O 121.114 0.483 . . . . 0.0 110.76 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 5.0 mt -130.91 -66.23 0.76 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.082 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 18.9 tt -178.18 158.57 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.208 179.735 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 6.0 mt -97.39 -82.91 0.4 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.75 -179.532 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 19.2 t30 -179.45 51.03 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.961 0.41 . . . . 0.0 111.041 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.4 pp -74.18 -32.48 63.1 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.027 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.47 -38.3 53.14 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.734 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.44 -29.12 20.43 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.783 179.691 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.67 -37.05 85.87 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.198 179.466 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.473 ' HG2' ' N ' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -85.27 -37.81 19.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.75 179.54 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.473 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -56.97 -46.73 81.98 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 179.101 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.413 ' N ' ' HG3' ' A' ' 14' ' ' GLU . 6.8 tp10 -66.42 -36.06 81.86 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 177.952 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.506 ' HA ' ' HG3' ' A' ' 46' ' ' LYS . . . -64.22 -39.76 94.64 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 115.147 -0.933 . . . . 0.0 110.193 179.368 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.424 HG12 ' O ' ' A' ' 13' ' ' LYS . 25.7 mm -54.39 -46.91 70.29 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.167 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 178.57 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 24.3 mmtm -62.01 -33.23 73.95 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.717 178.366 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -62.04 -52.53 63.59 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.613 179.55 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.517 ' HG ' ' CD1' ' A' ' 25' ' ' ILE . 0.2 OUTLIER -76.86 -34.4 57.82 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.942 -179.818 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.418 ' CG2' ' O ' ' A' ' 17' ' ' ILE . 52.8 t -63.08 -31.24 51.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 120.866 0.365 . . . . 0.0 110.188 179.535 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -90.26 -35.37 15.34 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.6 179.513 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.43 ' CB ' HG22 ' A' ' 53' ' ' THR . . . -79.02 -15.26 58.48 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.4 179.732 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.482 ' O ' ' CG2' ' A' ' 25' ' ' ILE . . . 44.37 105.9 0.01 OUTLIER Glycine 0 CA--C 1.526 0.758 0 N-CA-C 114.243 0.457 . . . . 0.0 114.243 179.009 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.517 ' CD1' ' HG ' ' A' ' 20' ' ' LEU . 1.7 pp -176.41 -170.86 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 CA-C-N 116.823 0.312 . . . . 0.0 110.556 178.646 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -35.91 94.97 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.325 0 N-CA-C 112.225 0.454 . . . . 0.0 112.225 -179.387 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.442 ' O ' ' N ' ' A' ' 30' ' ' ILE . 4.7 pt-20 -54.55 -25.38 25.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.67 179.572 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -43.08 -47.68 6.06 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.928 179.457 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.657 ' HA ' ' HG ' ' A' ' 32' ' ' LEU . 3.4 m-85 -63.12 -32.75 74.21 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.292 0.568 . . . . 0.0 110.092 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.442 ' N ' ' O ' ' A' ' 27' ' ' GLU . 1.4 tt -59.71 -26.27 34.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.67 178.295 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.5 tppp? -76.83 -37.06 56.36 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.637 179.583 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.657 ' HG ' ' HA ' ' A' ' 29' ' ' TYR . 0.2 OUTLIER -58.95 -34.06 71.32 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 120.299 -0.56 . . . . 0.0 109.802 179.379 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.428 HG13 ' O ' ' A' ' 30' ' ' ILE . 3.0 pt -91.68 -45.88 14.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.882 179.378 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -57.99 -28.89 64.8 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.747 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 11.0 t-20 -88.05 -15.99 34.83 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.079 179.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.516 ' O ' ' CB ' ' A' ' 37' ' ' LYS . . . 60.31 -137.84 0.65 Allowed 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.985 179.596 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.516 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 2.9 tppt? 93.69 -26.0 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 122.753 0.421 . . . . 0.0 110.87 -179.523 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 10.2 m -142.55 81.61 1.74 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.401 179.566 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 12.3 p -41.95 -47.32 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.349 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.588 -179.693 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.27 -42.43 95.4 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 179.3 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -69.85 -47.59 46.59 Favored Glycine 0 N--CA 1.448 -0.546 0 C-N-CA 120.506 -0.854 . . . . 0.0 111.949 178.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.432 ' CG1' ' HB3' ' A' ' 13' ' ' LYS . 17.0 t -43.14 -41.97 1.24 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.163 0 CA-C-O 121.134 0.492 . . . . 0.0 110.548 179.239 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 2.6 t-105 -77.17 -32.65 56.34 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.762 -0.653 . . . . 0.0 111.02 179.325 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.7 m -80.52 -52.14 7.96 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 120.815 0.341 . . . . 0.0 111.072 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.428 ' O ' HG23 ' A' ' 49' ' ' ILE . 0.4 OUTLIER -53.64 -34.2 57.76 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.922 179.445 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.514 ' O ' HG23 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -69.17 -60.64 2.21 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.02 179.233 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -57.76 -30.82 65.93 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.169 179.659 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -77.01 -52.74 8.82 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.103 179.701 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.514 HG23 ' O ' ' A' ' 46' ' ' LYS . 4.9 tp -57.12 -24.09 20.0 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.22 0 C-N-CA 120.589 -0.444 . . . . 0.0 111.054 -179.846 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.437 ' HA ' HG21 ' A' ' 53' ' ' THR . 1.5 tp -80.09 -35.14 37.32 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 178.735 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 50.2 m -57.68 -27.85 63.26 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.74 178.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.555 ' C ' ' CD1' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -87.89 13.41 10.9 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-O 120.782 0.325 . . . . 0.0 110.918 179.636 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.464 HG23 ' O ' ' A' ' 53' ' ' THR . 13.7 t -149.97 55.34 0.94 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.119 0.485 . . . . 0.0 111.344 -179.611 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 40.1 t -127.75 -79.77 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.147 179.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 39.6 m -75.87 114.16 14.17 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.699 0.285 . . . . 0.0 110.588 -179.703 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.148 -0.93 . . . . 0.0 110.729 179.757 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 22.5 p . . . . . 0 N--CA 1.494 1.742 0 CA-C-O 121.36 0.6 . . . . 0.0 111.073 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.433 ' O ' ' CG ' ' A' ' 3' ' ' TYR . 0.8 OUTLIER -168.22 -53.51 0.02 OUTLIER 'General case' 0 CA--C 1.521 -0.161 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.584 -179.92 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 0.433 ' CG ' ' O ' ' A' ' 2' ' ' THR . 54.6 p90 44.23 29.96 0.41 Allowed 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.536 -179.357 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.62 78.79 0.71 Allowed 'General case' 0 N--CA 1.454 -0.23 0 CA-C-O 121.191 0.519 . . . . 0.0 110.697 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 18.3 mt -145.54 -177.54 5.62 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.923 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 1.9 pt -113.91 146.74 18.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.137 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -91.71 -58.95 2.25 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.928 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -177.86 48.1 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.675 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.424 ' HB2' ' CB ' ' A' ' 39' ' ' VAL . 4.6 tt -79.1 -43.12 24.75 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.18 -179.647 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -54.5 -36.67 64.45 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.51 179.769 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -87.04 -32.33 20.05 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.381 179.511 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.64 -37.24 78.14 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.481 179.408 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.469 ' HG2' ' N ' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -85.1 -36.65 21.0 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.478 179.593 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.469 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 1.9 mm-40 -58.39 -50.39 73.86 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 178.949 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 56.5 tt0 -63.36 -34.55 77.97 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 177.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.475 ' HB3' HD12 ' A' ' 33' ' ' ILE . . . -63.57 -36.39 83.64 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 115.153 -0.93 . . . . 0.0 110.173 179.239 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.452 HG12 ' O ' ' A' ' 13' ' ' LYS . 20.4 mm -57.75 -49.17 81.73 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.139 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 178.762 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 20.4 mmtt -61.3 -33.14 73.08 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.97 178.651 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.01 -52.45 65.72 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.622 179.56 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.448 ' O ' ' N ' ' A' ' 24' ' ' GLY . 0.2 OUTLIER -76.16 -29.81 57.87 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.537 179.772 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 66.5 t -67.54 -31.2 51.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.959 0.409 . . . . 0.0 110.095 179.355 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -90.22 -33.84 16.03 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.191 179.423 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -84.66 -15.01 46.87 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.2 179.466 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.448 ' N ' ' O ' ' A' ' 20' ' ' LEU . . . 40.4 86.19 0.01 OUTLIER Glycine 0 C--N 1.334 0.444 0 CA-C-N 116.299 -0.409 . . . . 0.0 113.645 179.576 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.508 ' HB ' ' CE1' ' A' ' 52' ' ' PHE . 1.2 pp -172.66 138.54 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 CA-C-O 121.058 0.456 . . . . 0.0 112.033 179.53 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . 35.82 86.83 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 115.575 -0.739 . . . . 0.0 112.75 179.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -61.66 -28.58 69.49 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.164 0.507 . . . . 0.0 109.669 178.606 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -45.92 -45.8 15.66 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.639 179.06 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.606 ' HA ' ' HG ' ' A' ' 32' ' ' LEU . 3.4 m-85 -65.58 -30.07 70.75 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.156 0.503 . . . . 0.0 110.284 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 1.9 tt -61.8 -26.21 39.19 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 178.079 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.2 tppp? -76.33 -38.06 56.48 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.676 179.588 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.606 ' HG ' ' HA ' ' A' ' 29' ' ' TYR . 0.1 OUTLIER -59.72 -33.57 71.8 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 120.117 -0.633 . . . . 0.0 109.92 179.445 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.475 HD12 ' HB3' ' A' ' 16' ' ' ALA . 4.7 pt -90.18 -48.41 14.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.795 179.397 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -56.28 -28.07 57.48 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.95 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 20.9 t30 -91.54 -15.57 28.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.159 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.564 ' O ' ' CB ' ' A' ' 37' ' ' LYS . . . 60.58 -162.81 0.26 Allowed 'General case' 0 C--N 1.333 -0.11 0 CA-C-O 120.499 0.19 . . . . 0.0 111.005 179.673 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.564 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 6.3 tttt 138.14 -52.97 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 123.786 0.834 . . . . 0.0 109.081 -179.478 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -129.24 101.74 6.14 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.333 -0.849 . . . . 0.0 109.847 178.946 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.424 ' CB ' ' HB2' ' A' ' 9' ' ' LEU . 10.4 p -42.39 -38.09 0.77 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.326 0 CA-C-O 121.301 0.572 . . . . 0.0 110.81 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -69.84 -44.99 68.77 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.469 -0.787 . . . . 0.0 109.701 179.239 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -63.75 -45.16 95.08 Favored Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 120.349 -0.929 . . . . 0.0 111.335 178.745 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.449 ' CG1' ' HB3' ' A' ' 13' ' ' LYS . 11.7 t -48.18 -41.84 10.57 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-O 121.194 0.521 . . . . 0.0 110.008 178.919 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 48.2 t90 -77.34 -27.81 52.85 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.529 -0.76 . . . . 0.0 111.097 179.379 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.8 m -80.8 -48.84 11.9 Favored 'General case' 0 C--N 1.334 -0.107 0 CA-C-O 120.814 0.34 . . . . 0.0 111.035 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -58.61 -34.75 71.49 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.103 179.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.512 ' O ' HG22 ' A' ' 49' ' ' ILE . 12.2 tttm -68.46 -59.89 2.83 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.63 -0.713 . . . . 0.0 110.305 179.379 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -58.47 -31.03 67.44 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.361 179.681 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -77.1 -53.12 8.18 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.835 -0.621 . . . . 0.0 111.081 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.541 ' O ' ' HD1' ' A' ' 52' ' ' PHE . 4.6 tp -57.49 -23.91 20.77 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.143 0 C-N-CA 120.824 -0.35 . . . . 0.0 111.179 -179.872 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 2.0 tp -81.69 -32.34 31.75 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.692 -0.484 . . . . 0.0 109.692 178.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.433 ' HA ' ' CG2' ' A' ' 54' ' ' VAL . 17.0 m -64.79 -23.74 67.34 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.706 179.767 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.541 ' HD1' ' O ' ' A' ' 49' ' ' ILE . 0.0 OUTLIER -83.45 16.7 2.45 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 121.245 0.545 . . . . 0.0 111.351 179.871 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.425 ' O ' ' CG2' ' A' ' 53' ' ' THR . 3.1 m -175.7 69.36 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 108.469 -0.937 . . . . 0.0 108.469 178.955 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.433 ' CG2' ' HA ' ' A' ' 51' ' ' THR . 0.0 OUTLIER -128.36 -81.25 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.381 -0.827 . . . . 0.0 111.42 -178.362 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.6 m 68.78 151.88 0.09 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.966 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 59.1 mt-10 . . . . . 0 C--O 1.246 0.888 0 CA-C-O 118.4 -0.809 . . . . 0.0 110.825 179.984 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 62.1 m . . . . . 0 N--CA 1.491 1.62 0 CA-C-O 120.701 0.286 . . . . 0.0 111.143 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 14.9 p -132.62 143.2 49.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.209 179.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 0.463 ' HB2' ' CD1' ' A' ' 5' ' ' LEU . 9.2 p90 -116.24 -38.95 3.47 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.563 179.857 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 62.79 66.58 0.75 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.843 179.782 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.463 ' CD1' ' HB2' ' A' ' 3' ' ' TYR . 5.5 mp -139.71 -55.89 0.56 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.951 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 20.7 mt -117.18 140.44 39.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.936 -179.566 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 20.6 mt 66.99 -171.22 0.19 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.399 179.762 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 12.4 t30 178.82 49.77 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.96 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.432 ' HB2' ' CB ' ' A' ' 39' ' ' VAL . 6.5 tt -76.28 -46.37 28.19 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.43 -179.095 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 4.9 mtpt -52.92 -37.79 61.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.8 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -87.52 -29.13 21.56 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.861 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.403 ' HB3' ' HA ' ' A' ' 9' ' ' LEU . . . -63.58 -36.62 84.39 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.196 179.497 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.469 ' HB3' ' CG1' ' A' ' 42' ' ' VAL . 0.0 OUTLIER -85.27 -36.38 20.92 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.903 179.549 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.454 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 5.4 pt-20 -59.87 -50.11 75.08 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 179.159 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.443 ' N ' ' CG ' ' A' ' 14' ' ' GLU . 1.1 tp10 -65.0 -36.32 84.04 Favored 'General case' 0 CA--C 1.516 -0.345 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 178.183 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.45 ' CB ' ' HB2' ' A' ' 46' ' ' LYS . . . -64.45 -34.29 77.86 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 115.234 -0.893 . . . . 0.0 110.308 179.461 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.412 ' O ' ' CG2' ' A' ' 21' ' ' VAL . 1.3 mp -59.81 -45.83 94.37 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.277 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 178.808 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 11.3 mttt -65.46 -33.07 75.09 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.56 -0.746 . . . . 0.0 109.966 178.629 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.411 ' HB3' HD13 ' A' ' 50' ' ' LEU . 0.5 OUTLIER -56.88 -52.58 64.57 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.315 179.996 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.419 ' HG ' HG13 ' A' ' 25' ' ' ILE . 0.2 OUTLIER -77.63 -32.76 53.63 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.768 0.318 . . . . 0.0 110.711 -179.859 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.412 ' CG2' ' O ' ' A' ' 17' ' ' ILE . 55.6 t -62.82 -31.39 52.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-O 120.87 0.367 . . . . 0.0 110.203 179.464 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -90.82 -36.98 13.91 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.2 179.368 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -77.07 -14.92 59.75 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.072 179.367 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.408 ' N ' ' O ' ' A' ' 20' ' ' LEU . . . 49.71 100.99 0.01 OUTLIER Glycine 0 CA--C 1.523 0.533 0 C-N-CA 121.185 -0.531 . . . . 0.0 113.274 179.447 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.441 HG23 ' CE1' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -168.84 -169.55 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.253 0 CA-C-N 117.029 0.415 . . . . 0.0 111.403 179.345 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -43.24 95.33 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.006 -0.543 . . . . 0.0 112.143 -179.401 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.415 ' O ' ' N ' ' A' ' 30' ' ' ILE . 0.6 OUTLIER -52.61 -25.9 11.97 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.292 0.568 . . . . 0.0 110.513 179.107 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.9 tptm -46.3 -44.91 17.01 Favored 'General case' 0 C--O 1.238 0.493 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.168 179.067 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.584 ' HA ' ' HG ' ' A' ' 32' ' ' LEU . 2.7 m-85 -61.46 -31.8 71.78 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.003 179.72 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.429 ' O ' HG13 ' A' ' 33' ' ' ILE . 43.6 mt -60.65 -26.47 38.06 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.331 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 177.97 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -74.98 -37.32 61.94 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.694 179.429 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.584 ' HG ' ' HA ' ' A' ' 29' ' ' TYR . 0.1 OUTLIER -60.52 -33.37 72.55 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 120.03 -0.668 . . . . 0.0 109.841 179.55 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.437 HD12 HG22 ' A' ' 33' ' ' ILE . 3.7 pt -91.72 -46.69 14.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.987 179.619 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -58.71 -29.51 66.73 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.741 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 -85.06 -12.91 51.96 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.921 179.841 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.545 ' O ' ' CB ' ' A' ' 37' ' ' LYS . . . 58.59 -139.9 0.76 Allowed 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 116.656 -0.247 . . . . 0.0 110.97 179.445 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.545 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 0.4 OUTLIER 95.68 -27.12 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 122.797 0.439 . . . . 0.0 110.796 -179.855 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 55.5 p -143.65 83.14 1.75 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.624 179.671 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.432 ' CB ' ' HB2' ' A' ' 9' ' ' LEU . 8.1 p -40.63 -48.85 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.494 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 30.0 mm-40 -61.58 -41.45 97.43 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.283 -0.417 . . . . 0.0 109.957 179.61 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -68.03 -47.12 61.56 Favored Glycine 0 N--CA 1.448 -0.555 0 C-N-CA 120.519 -0.848 . . . . 0.0 111.788 178.733 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.469 ' CG1' ' HB3' ' A' ' 13' ' ' LYS . 11.9 t -43.8 -41.9 1.65 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.164 0 CA-C-O 121.276 0.56 . . . . 0.0 110.254 179.026 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 73.7 t-105 -78.3 -31.26 48.76 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.549 -0.751 . . . . 0.0 111.304 179.333 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.9 m -79.12 -49.2 12.98 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.84 0.352 . . . . 0.0 110.959 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 1.8 mt -56.88 -34.9 68.32 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.064 -0.516 . . . . 0.0 109.928 179.459 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.481 ' O ' HG21 ' A' ' 49' ' ' ILE . 12.8 tttm -67.87 -59.82 2.99 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.479 179.486 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.74 -32.64 69.41 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.497 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -76.19 -53.65 7.96 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.918 179.885 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.542 HG12 ' CB ' ' A' ' 29' ' ' TYR . 9.1 tp -58.41 -24.4 24.85 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.152 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.162 -179.73 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.411 HD13 ' HB3' ' A' ' 19' ' ' GLU . 4.1 tp -78.87 -34.54 44.86 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 178.753 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 35.6 m -58.35 -34.82 71.07 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.913 179.354 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.794 ' O ' ' CG ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -75.12 57.96 0.87 Allowed 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 121.577 0.703 . . . . 0.0 110.76 179.979 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.1 m 170.44 -64.34 0.01 OUTLIER 'General case' 0 C--O 1.231 0.117 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 179.839 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 2.7 t -77.6 75.15 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.661 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.277 179.707 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER 170.03 -65.22 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.623 -179.864 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 . . . . . 0 C--O 1.25 1.107 0 CA-C-O 118.205 -0.902 . . . . 0.0 110.817 179.943 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 3.1 p . . . . . 0 N--CA 1.487 1.394 0 CA-C-O 120.987 0.422 . . . . 0.0 111.109 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -146.1 144.08 29.77 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.001 0.429 . . . . 0.0 110.973 179.671 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -98.15 34.95 1.83 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.05 179.694 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.1 tmtt? -149.72 84.2 1.41 Allowed 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.84 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 5.0 mp -150.38 167.88 25.77 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.717 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -145.51 -44.68 0.12 Allowed 'Isoleucine or valine' 0 C--O 1.223 -0.301 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.45 179.738 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 39.8 tp -167.01 -77.94 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.816 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 21.7 p30 -162.14 40.38 0.13 Allowed 'General case' 0 N--CA 1.454 -0.261 0 CA-C-O 120.929 0.395 . . . . 0.0 110.767 -179.682 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 4.0 tt -80.09 -47.73 14.35 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.643 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.408 ' HA ' ' HD3' ' A' ' 13' ' ' LYS . 3.7 mtmp? -54.18 -32.68 56.18 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.562 179.641 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.414 ' O ' ' HG2' ' A' ' 14' ' ' GLU . 0.8 OUTLIER -87.7 -32.94 18.93 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.55 179.551 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.62 -36.75 76.95 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.269 179.368 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.484 ' HG2' ' N ' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -85.04 -37.99 19.71 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.592 179.406 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.484 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 4.5 pt-20 -56.36 -49.56 74.07 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 178.902 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.424 ' N ' ' CG ' ' A' ' 14' ' ' GLU . 60.4 tt0 -63.38 -34.01 76.8 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 177.64 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.511 ' HB3' HD12 ' A' ' 33' ' ' ILE . . . -63.71 -39.53 94.52 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 115.143 -0.935 . . . . 0.0 109.968 179.073 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.463 HG12 ' O ' ' A' ' 13' ' ' LYS . 28.8 mm -55.61 -49.69 72.12 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.2 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 178.523 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.6 -32.15 70.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.304 -0.862 . . . . 0.0 109.695 178.399 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.42 ' HB3' HD12 ' A' ' 50' ' ' LEU . 0.2 OUTLIER -65.97 -52.47 49.29 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.637 179.533 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.74 -32.97 68.31 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.392 179.768 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 65.4 t -63.87 -31.44 53.18 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.207 0 CA-C-N 116.311 -0.404 . . . . 0.0 109.973 179.113 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -85.19 -38.4 19.03 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.946 179.199 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -76.1 -15.09 60.16 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.968 179.267 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.419 ' C ' HG13 ' A' ' 25' ' ' ILE . . . 39.81 89.8 0.01 OUTLIER Glycine 0 CA--C 1.523 0.552 0 CA-C-N 116.144 -0.48 . . . . 0.0 114.243 179.019 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.419 HG13 ' C ' ' A' ' 24' ' ' GLY . 0.0 OUTLIER -153.43 -167.65 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.268 0 CA-C-N 116.78 0.29 . . . . 0.0 110.702 179.028 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.414 ' HB1' ' CE2' ' A' ' 29' ' ' TYR . . . -46.65 97.22 0.01 OUTLIER 'General case' 0 C--O 1.232 0.149 0 CA-C-O 120.927 0.394 . . . . 0.0 111.344 -179.6 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.489 ' O ' ' N ' ' A' ' 30' ' ' ILE . 0.2 OUTLIER -45.28 -25.43 0.38 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.268 179.574 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -40.95 -48.23 3.13 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 121.436 0.636 . . . . 0.0 110.839 179.463 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.576 ' HA ' ' HG ' ' A' ' 32' ' ' LEU . 58.1 m-85 -60.63 -33.65 73.09 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.14 179.87 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.489 ' N ' ' O ' ' A' ' 27' ' ' GLU . 1.8 tt -60.39 -26.29 36.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.641 -0.709 . . . . 0.0 109.676 178.392 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.32 -36.88 58.07 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.761 179.598 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.576 ' HG ' ' HA ' ' A' ' 29' ' ' TYR . 0.1 OUTLIER -58.88 -33.9 71.03 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 120.229 -0.588 . . . . 0.0 109.634 179.315 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.511 HD12 ' HB3' ' A' ' 16' ' ' ALA . 2.5 pt -91.75 -46.43 14.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.723 179.266 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -58.44 -29.5 66.18 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.757 -179.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 25.6 t30 -84.95 -16.32 41.39 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.015 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.539 ' O ' ' CB ' ' A' ' 37' ' ' LYS . . . 59.07 -136.93 0.81 Allowed 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.137 179.505 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.539 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 25.0 tttt 95.29 -27.32 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 122.851 0.46 . . . . 0.0 110.667 -179.478 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 60.1 p -142.25 83.68 1.84 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.332 179.522 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 8.6 p -39.57 -49.45 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.566 -179.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.62 -43.17 99.35 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.873 -0.418 . . . . 0.0 109.873 179.289 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -65.75 -46.13 84.94 Favored Glycine 0 N--CA 1.447 -0.568 0 C-N-CA 120.447 -0.883 . . . . 0.0 111.724 178.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.455 ' CG1' ' HB3' ' A' ' 13' ' ' LYS . 14.6 t -45.44 -41.6 3.09 Favored 'Isoleucine or valine' 0 C--O 1.233 0.217 0 CA-C-O 121.126 0.489 . . . . 0.0 110.261 179.048 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 69.1 t90 -77.2 -30.57 54.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.0 179.382 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.4 m -79.39 -49.15 12.8 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 120.804 0.335 . . . . 0.0 110.91 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.412 ' O ' HG23 ' A' ' 49' ' ' ILE . 3.5 mm? -56.78 -36.03 69.38 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.239 179.4 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.5 ' O ' HG23 ' A' ' 49' ' ' ILE . 15.5 ttpp -67.83 -58.85 3.89 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.604 179.523 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.48 -32.37 68.7 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.293 179.789 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 17.1 tt0 -77.22 -53.52 7.63 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.981 179.815 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.574 ' O ' ' CD1' ' A' ' 52' ' ' PHE . 3.6 tp -56.61 -23.97 18.26 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.289 0 C-N-CA 120.902 -0.319 . . . . 0.0 111.217 -179.773 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.42 HD12 ' HB3' ' A' ' 19' ' ' GLU . 1.8 tp -81.65 -33.32 31.41 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 178.766 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.435 ' HA ' HG23 ' A' ' 54' ' ' VAL . 17.1 m -64.43 -18.52 64.81 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.66 179.41 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.574 ' CD1' ' O ' ' A' ' 49' ' ' ILE . 0.0 OUTLIER -88.19 36.02 0.77 Allowed 'General case' 0 CA--C 1.531 0.223 0 CA-C-O 121.338 0.589 . . . . 0.0 111.361 -179.709 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.427 ' OG1' ' O ' ' A' ' 52' ' ' PHE . 2.4 m 176.25 -67.9 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.09 179.418 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.435 HG23 ' HA ' ' A' ' 51' ' ' THR . 70.9 t 53.44 102.35 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 CA-C-N 115.736 -0.666 . . . . 0.0 111.46 179.254 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -75.52 113.8 13.34 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.662 -179.771 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 . . . . . 0 C--O 1.249 1.079 0 CA-C-O 118.25 -0.881 . . . . 0.0 110.87 -179.983 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 7.5 t . . . . . 0 N--CA 1.486 1.329 0 CA-C-O 120.711 0.291 . . . . 0.0 111.144 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -147.18 129.88 16.06 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-O 120.999 0.428 . . . . 0.0 110.895 -179.869 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 47.5 p90 -98.43 40.56 1.18 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.842 -179.763 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -151.3 73.33 1.09 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.987 -179.762 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.5 mp -143.5 -45.91 0.28 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.949 179.816 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 1.1 pt -79.96 143.99 11.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 121.087 0.47 . . . . 0.0 110.911 -179.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -171.11 -170.83 0.89 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.891 -179.857 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -152.95 36.12 0.48 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.673 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 6.8 tt -84.82 -48.46 9.34 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.118 -179.595 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 45.9 tttp -52.79 -35.34 56.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.901 179.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.37 -32.85 19.37 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.62 179.825 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.91 -37.99 77.91 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.314 179.344 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.444 ' HB3' ' CG1' ' A' ' 42' ' ' VAL . 0.0 OUTLIER -85.38 -35.4 21.38 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.784 -0.643 . . . . 0.0 111.021 179.754 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.439 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 0.3 OUTLIER -58.52 -42.18 87.12 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 121.505 0.669 . . . . 0.0 109.299 179.086 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.41 ' N ' ' HG3' ' A' ' 14' ' ' GLU . 0.4 OUTLIER -72.75 -31.1 64.67 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.311 -0.859 . . . . 0.0 108.89 177.864 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.529 ' HB3' HD12 ' A' ' 33' ' ' ILE . . . -69.63 -42.44 74.32 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.184 -0.917 . . . . 0.0 111.335 179.903 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.458 HG21 ' N ' ' A' ' 18' ' ' LYS . 2.2 tp -61.6 -37.35 77.69 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.243 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 179.085 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.458 ' N ' HG21 ' A' ' 17' ' ' ILE . 0.0 OUTLIER -69.64 -32.46 71.16 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 177.491 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.467 ' HB2' ' HA ' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -62.03 -52.68 63.0 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.999 179.479 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.5 ' HG ' HG13 ' A' ' 25' ' ' ILE . 0.2 OUTLIER -74.95 -35.02 62.13 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.133 -179.442 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.421 ' CG2' ' O ' ' A' ' 17' ' ' ILE . 41.8 t -63.58 -31.25 52.24 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-O 120.838 0.351 . . . . 0.0 110.284 179.493 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -91.69 -33.12 15.18 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.638 179.571 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.419 ' O ' ' O ' ' A' ' 24' ' ' GLY . . . -82.48 -15.05 53.91 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.579 179.858 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.419 ' O ' ' O ' ' A' ' 23' ' ' ALA . . . 48.76 105.02 0.01 OUTLIER Glycine 0 CA--C 1.524 0.643 0 C-N-CA 121.136 -0.554 . . . . 0.0 113.104 179.607 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.5 HG13 ' HG ' ' A' ' 20' ' ' LEU . 0.7 OUTLIER -177.43 -173.67 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.199 0 CA-C-N 117.213 0.506 . . . . 0.0 111.709 179.715 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -37.03 95.15 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 115.964 -0.562 . . . . 0.0 112.358 -179.15 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.438 ' O ' ' N ' ' A' ' 30' ' ' ILE . 9.8 tt0 -54.92 -25.36 28.76 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.559 179.143 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.8 tptm -44.63 -47.94 10.46 Favored 'General case' 0 C--O 1.239 0.51 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.699 179.389 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.594 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 2.7 m-85 -64.34 -30.39 71.44 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.278 0.561 . . . . 0.0 109.855 179.582 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.438 ' N ' ' O ' ' A' ' 27' ' ' GLU . 0.6 OUTLIER -61.58 -26.4 39.51 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 CA-C-N 115.846 -0.615 . . . . 0.0 109.402 178.056 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -75.88 -38.06 58.25 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.73 179.524 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.594 ' HG ' ' O ' ' A' ' 29' ' ' TYR . 0.0 OUTLIER -61.02 -32.0 71.61 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 119.962 -0.695 . . . . 0.0 109.876 179.528 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.529 HD12 ' HB3' ' A' ' 16' ' ' ALA . 4.1 pt -91.7 -46.47 14.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.986 179.334 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -58.74 -29.03 66.41 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.807 -179.735 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -89.15 -16.43 31.42 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.963 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.537 ' O ' ' CB ' ' A' ' 37' ' ' LYS . . . 62.52 -139.98 0.42 Allowed 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 116.682 -0.236 . . . . 0.0 111.007 179.603 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.537 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 0.0 OUTLIER 95.83 -27.63 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 122.818 0.447 . . . . 0.0 110.712 -179.73 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.88 83.14 1.87 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.435 179.618 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 9.2 p -40.93 -48.64 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.4 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.501 -179.849 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -62.11 -41.11 97.89 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 179.533 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -67.7 -47.11 63.43 Favored Glycine 0 N--CA 1.448 -0.511 0 C-N-CA 120.483 -0.865 . . . . 0.0 111.84 178.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.444 ' CG1' ' HB3' ' A' ' 13' ' ' LYS . 7.4 t -45.12 -40.43 2.32 Favored 'Isoleucine or valine' 0 C--O 1.232 0.139 0 CA-C-O 121.23 0.538 . . . . 0.0 110.198 179.161 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 60.8 t-105 -77.98 -31.52 50.8 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.985 179.186 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.8 m -78.66 -53.7 6.89 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.867 0.365 . . . . 0.0 110.988 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 3.3 mt -55.14 -34.47 63.79 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.307 179.66 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.512 ' O ' HG23 ' A' ' 49' ' ' ILE . 4.9 tttm -67.48 -58.64 4.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.229 179.446 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -60.5 -30.16 69.54 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.392 179.792 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -78.5 -53.15 7.53 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.109 179.847 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.563 ' O ' ' HD1' ' A' ' 52' ' ' PHE . 4.4 tp -55.69 -24.14 15.96 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.122 0 C-N-CA 120.961 -0.296 . . . . 0.0 110.912 -179.906 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.408 HD12 ' HB3' ' A' ' 19' ' ' GLU . 0.7 OUTLIER -82.39 -33.45 28.71 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 178.523 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 24.2 m -59.21 -24.93 63.56 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.13 179.172 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.579 ' O ' ' CG ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -86.84 19.59 2.92 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-O 121.139 0.495 . . . . 0.0 111.078 179.94 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.414 ' O ' ' CG2' ' A' ' 53' ' ' THR . 5.3 t -148.12 53.96 1.03 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.049 0.452 . . . . 0.0 111.369 179.374 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 20.9 t -145.24 115.41 1.75 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.191 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -133.61 72.51 1.48 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.829 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.248 0.996 0 CA-C-O 118.089 -0.958 . . . . 0.0 110.959 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 74.5 p . . . . . 0 N--CA 1.49 1.563 0 CA-C-O 120.989 0.423 . . . . 0.0 111.197 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 1.6 p -76.3 -59.65 2.68 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.827 -179.638 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER 58.86 22.79 10.61 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.865 -179.913 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -169.89 103.03 0.31 Allowed 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.66 180.0 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.415 ' N ' ' CD2' ' A' ' 5' ' ' LEU . 1.2 mm? -98.95 113.27 25.35 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.07 0.462 . . . . 0.0 110.826 -179.391 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.415 HD12 HG21 ' A' ' 6' ' ' ILE . 24.3 mt 69.63 9.48 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.453 -0.28 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.889 179.459 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 50.81 -169.0 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.701 0.286 . . . . 0.0 111.002 179.762 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -134.46 -49.68 0.78 Allowed 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 116.528 -0.306 . . . . 0.0 111.702 179.423 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.401 ' CD2' ' HB3' ' A' ' 36' ' ' ALA . 8.9 tt -52.19 -48.93 64.78 Favored 'General case' 0 N--CA 1.456 -0.132 0 CA-C-O 121.003 0.43 . . . . 0.0 111.272 179.738 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.442 ' HA ' ' HD3' ' A' ' 13' ' ' LYS . 1.3 ttpp -52.89 -35.32 57.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.957 -179.852 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.89 -29.15 19.84 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.872 -179.988 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.34 -37.59 87.87 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.143 179.374 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.442 ' HD3' ' HA ' ' A' ' 10' ' ' LYS . 0.0 OUTLIER -85.42 -35.49 21.26 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.96 179.712 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.432 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 0.3 OUTLIER -60.03 -44.91 94.3 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.43 0.633 . . . . 0.0 109.312 179.206 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.409 ' N ' ' HG3' ' A' ' 14' ' ' GLU . 0.9 OUTLIER -70.18 -31.05 68.34 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.531 -0.758 . . . . 0.0 109.05 177.967 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.451 ' HB2' HD11 ' A' ' 33' ' ' ILE . . . -71.19 -38.32 72.09 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.221 -0.9 . . . . 0.0 111.329 -179.886 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.509 HG21 ' N ' ' A' ' 18' ' ' LYS . 1.7 tp -63.51 -34.87 70.13 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.289 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 179.338 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.509 ' N ' HG21 ' A' ' 17' ' ' ILE . 1.5 mmmp? -72.26 -32.32 66.55 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 109.082 -0.71 . . . . 0.0 109.082 177.667 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.401 ' HB2' ' HA ' ' A' ' 16' ' ' ALA . 0.5 OUTLIER -63.77 -52.72 59.08 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.22 -0.9 . . . . 0.0 111.076 179.745 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.477 ' HG ' HG12 ' A' ' 25' ' ' ILE . 0.2 OUTLIER -73.93 -35.82 64.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.212 -179.52 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.414 ' CG2' ' O ' ' A' ' 17' ' ' ILE . 33.0 t -63.29 -31.17 51.79 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-O 120.833 0.349 . . . . 0.0 110.32 179.552 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -90.04 -34.08 16.08 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.506 179.605 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.404 ' HB3' HG21 ' A' ' 53' ' ' THR . . . -80.23 -15.12 57.71 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.534 179.723 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 46.09 94.81 0.01 OUTLIER Glycine 0 CA--C 1.522 0.471 0 C-N-CA 121.001 -0.619 . . . . 0.0 113.237 179.724 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.487 ' N ' ' CD1' ' A' ' 25' ' ' ILE . 0.1 OUTLIER -160.63 -172.15 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.333 -0.13 0 CA-C-N 116.752 0.276 . . . . 0.0 111.239 179.87 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -41.47 94.75 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.948 -179.607 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.422 ' O ' ' N ' ' A' ' 30' ' ' ILE . 0.0 OUTLIER -50.88 -25.61 4.76 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.623 179.59 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -45.89 -46.95 16.17 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-O 121.303 0.573 . . . . 0.0 110.548 179.195 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.654 ' HA ' ' HG ' ' A' ' 32' ' ' LEU . 3.0 m-85 -64.19 -29.78 70.87 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.279 0.562 . . . . 0.0 109.895 179.688 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.422 ' N ' ' O ' ' A' ' 27' ' ' GLU . 1.0 OUTLIER -62.38 -26.44 40.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.379 177.934 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -75.3 -36.05 61.19 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.403 179.373 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.654 ' HG ' ' HA ' ' A' ' 29' ' ' TYR . 0.2 OUTLIER -60.4 -34.66 74.24 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 120.263 -0.575 . . . . 0.0 109.826 179.146 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.451 HD11 ' HB2' ' A' ' 16' ' ' ALA . 5.5 pt -89.99 -46.33 15.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.943 179.414 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -61.11 -29.62 69.87 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.952 -179.46 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 33.1 t30 -84.99 -20.84 29.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.017 179.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.495 ' O ' ' CB ' ' A' ' 37' ' ' LYS . . . 63.37 -140.01 0.35 Allowed 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.976 179.609 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.495 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 1.5 tpmp? 90.14 -22.38 0.11 Allowed 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 122.607 0.363 . . . . 0.0 111.221 -179.76 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -143.37 79.03 1.62 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.586 -0.279 . . . . 0.0 110.617 179.611 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.442 ' HA ' HG23 ' A' ' 42' ' ' VAL . 11.6 p -38.8 -49.05 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.445 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.767 -179.681 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.48 ' HA ' ' CD1' ' A' ' 43' ' ' TRP . 0.2 OUTLIER -59.72 -47.53 85.27 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 179.511 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -66.62 -40.25 94.02 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.412 -0.899 . . . . 0.0 112.452 179.269 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.442 HG23 ' HA ' ' A' ' 39' ' ' VAL . 21.4 t -47.07 -48.65 8.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 117.114 0.457 . . . . 0.0 110.56 179.627 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . 0.48 ' CD1' ' HA ' ' A' ' 40' ' ' GLU . 15.4 p-90 -77.27 -26.16 52.15 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.444 179.617 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.8 m -79.68 -42.16 25.33 Favored 'General case' 0 N--CA 1.462 0.167 0 C-N-CA 120.599 -0.44 . . . . 0.0 110.983 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -62.64 -33.77 75.71 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.133 -0.485 . . . . 0.0 109.846 179.405 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.461 ' O ' HG21 ' A' ' 49' ' ' ILE . 8.6 ttpt -68.89 -62.12 1.52 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.229 179.292 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -55.7 -28.79 57.58 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.343 179.752 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -80.03 -54.72 5.52 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-N 115.828 -0.623 . . . . 0.0 110.713 179.589 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.62 ' O ' ' HD1' ' A' ' 52' ' ' PHE . 7.0 tp -58.69 -23.99 24.68 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.187 0 CA-C-O 120.86 0.362 . . . . 0.0 110.856 179.839 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 2.3 tp -80.3 -33.42 37.61 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.268 -0.642 . . . . 0.0 109.268 178.375 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 29.3 m -58.21 -29.71 65.91 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.783 179.085 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.62 ' HD1' ' O ' ' A' ' 49' ' ' ILE . 0.0 OUTLIER -82.3 12.28 4.56 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-O 120.89 0.376 . . . . 0.0 111.037 179.576 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.497 ' CG2' ' O ' ' A' ' 53' ' ' THR . 2.8 t -148.06 54.28 1.03 Allowed 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 121.204 0.526 . . . . 0.0 111.187 179.454 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.416 ' O ' ' N ' ' A' ' 56' ' ' GLU . 21.3 t -124.96 105.49 15.12 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.3 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.269 179.913 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 3.2 p 52.12 -86.81 0.01 OUTLIER 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.449 -179.6 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.416 ' N ' ' O ' ' A' ' 54' ' ' VAL . 2.4 mt-10 . . . . . 0 C--O 1.25 1.111 0 CA-C-O 118.191 -0.909 . . . . 0.0 110.881 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 19.6 m . . . . . 0 N--CA 1.485 1.285 0 CA-C-O 120.952 0.406 . . . . 0.0 111.052 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -167.74 -57.34 0.02 OUTLIER 'General case' 0 C--O 1.235 0.294 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.438 -179.883 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER 57.64 22.85 8.71 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.739 -179.79 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 5.1 ttpt -159.28 -44.67 0.05 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.924 179.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.3 mp 63.61 141.9 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.365 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.505 ' O ' ' HB2' ' A' ' 7' ' ' LEU . 0.9 OUTLIER -179.91 -42.95 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.135 179.767 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.505 ' HB2' ' O ' ' A' ' 6' ' ' ILE . 2.8 mm? 75.26 -16.89 0.54 Allowed 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 115.767 -0.651 . . . . 0.0 112.47 179.8 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . 0.422 ' CB ' ' O ' ' A' ' 7' ' ' LEU . 0.8 OUTLIER 79.78 34.91 0.16 Allowed 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 121.289 0.566 . . . . 0.0 110.062 -179.444 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -85.16 -48.74 8.85 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.696 -179.704 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.452 ' HA ' ' HD3' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -56.82 -35.29 68.61 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.017 -179.969 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.3 -38.07 16.6 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.937 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.37 -37.42 70.04 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.645 179.623 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.452 ' HD3' ' HA ' ' A' ' 10' ' ' LYS . 0.0 OUTLIER -85.19 -35.38 21.69 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.679 179.587 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.444 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 3.0 mm-40 -59.44 -50.43 73.97 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 179.059 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -63.77 -36.83 85.19 Favored 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 108.925 -0.768 . . . . 0.0 108.925 178.033 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.505 ' HB2' HD13 ' A' ' 33' ' ' ILE . . . -64.21 -35.04 79.5 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-N 115.092 -0.958 . . . . 0.0 110.346 179.483 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.406 ' O ' ' CG2' ' A' ' 21' ' ' VAL . 1.4 mp -58.62 -47.44 88.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 178.965 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 4.6 mmmt -63.13 -33.12 74.77 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.936 178.59 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.43 ' HB3' HD13 ' A' ' 50' ' ' LEU . 0.2 OUTLIER -57.77 -52.49 65.25 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.873 179.618 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.461 ' HG ' ' CD1' ' A' ' 25' ' ' ILE . 0.2 OUTLIER -76.06 -30.63 58.44 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.703 -0.399 . . . . 0.0 110.37 179.77 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.406 ' CG2' ' O ' ' A' ' 17' ' ' ILE . 53.1 t -62.76 -31.28 51.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 178.733 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -86.91 -39.89 15.34 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.878 178.975 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.91 -15.05 61.15 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.795 179.033 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.419 ' C ' HG13 ' A' ' 25' ' ' ILE . . . 43.48 77.69 0.08 OUTLIER Glycine 0 C--N 1.333 0.396 0 CA-C-N 116.013 -0.539 . . . . 0.0 114.224 179.136 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.461 ' CD1' ' HG ' ' A' ' 20' ' ' LEU . 0.2 OUTLIER -141.83 -171.74 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.246 0 CA-C-O 120.734 0.302 . . . . 0.0 110.785 178.745 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.417 ' HB3' ' CE2' ' A' ' 29' ' ' TYR . . . -44.57 97.64 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.676 -179.477 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.489 ' O ' ' N ' ' A' ' 30' ' ' ILE . 10.5 pt-20 -45.85 -25.23 0.49 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.16 179.187 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -41.29 -47.61 3.47 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 121.45 0.643 . . . . 0.0 110.8 179.456 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.577 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 63.3 m-85 -59.3 -32.39 70.01 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.336 179.909 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.489 ' N ' ' O ' ' A' ' 27' ' ' GLU . 25.8 mt -62.21 -26.64 40.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.464 177.969 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 6.3 tttm -74.29 -36.1 63.75 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.61 179.662 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.577 ' HG ' ' O ' ' A' ' 29' ' ' TYR . 0.1 OUTLIER -61.51 -33.97 74.71 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 120.216 -0.594 . . . . 0.0 109.815 179.353 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.505 HD13 ' HB2' ' A' ' 16' ' ' ALA . 2.4 pt -91.91 -44.71 14.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.046 179.408 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.421 ' CB ' ' O ' ' A' ' 30' ' ' ILE . . . -61.1 -30.99 70.69 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.079 -179.651 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 23.6 t30 -81.57 -3.05 52.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.114 -179.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.453 ' HA ' HG23 ' A' ' 42' ' ' VAL . . . 49.92 -131.04 1.95 Allowed 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 116.549 -0.296 . . . . 0.0 111.242 179.465 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 76.16 -5.65 2.14 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -159.9 71.41 0.47 Allowed 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 110.287 -0.264 . . . . 0.0 110.287 179.684 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.441 ' HA ' HG21 ' A' ' 42' ' ' VAL . 11.9 p -38.69 -50.63 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.906 -179.564 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -61.05 -43.28 99.12 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 109.954 -0.388 . . . . 0.0 109.954 179.321 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -66.9 -45.69 81.07 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.474 -0.869 . . . . 0.0 111.902 178.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.453 HG23 ' HA ' ' A' ' 36' ' ' ALA . 15.5 t -45.94 -39.36 3.17 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.111 0 CA-C-O 121.208 0.528 . . . . 0.0 110.352 179.141 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 45.9 t-105 -78.3 -32.06 49.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.586 179.004 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 m -77.74 -50.99 11.26 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.982 179.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.418 ' O ' HG22 ' A' ' 49' ' ' ILE . 0.9 OUTLIER -56.9 -34.51 67.98 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.314 179.543 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.512 ' O ' HG22 ' A' ' 49' ' ' ILE . 11.3 ttpp -67.52 -58.42 4.74 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.633 179.877 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 4.7 p30 -62.64 -27.43 69.21 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.362 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -79.98 -51.29 9.25 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.74 179.64 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.561 HG12 ' CB ' ' A' ' 29' ' ' TYR . 3.8 tp -57.49 -24.24 21.5 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 C-N-CA 120.741 -0.383 . . . . 0.0 110.917 179.997 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.43 HD13 ' HB3' ' A' ' 19' ' ' GLU . 2.3 tp -82.05 -35.15 29.06 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 178.89 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 10.8 m -65.22 -14.52 60.86 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 115.602 -0.726 . . . . 0.0 111.677 179.49 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.564 ' O ' ' CG ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -91.2 30.81 1.19 Allowed 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 121.288 0.566 . . . . 0.0 111.551 -179.498 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.414 ' OG1' ' O ' ' A' ' 52' ' ' PHE . 7.5 m -174.83 70.77 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.46 179.147 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 9.1 p -157.56 156.48 4.21 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.526 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.628 -179.762 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.48 -68.29 0.29 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.915 -179.809 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.395 -0.812 . . . . 0.0 110.803 -179.864 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 4.1 p . . . . . 0 N--CA 1.486 1.34 0 CA-C-O 120.656 0.265 . . . . 0.0 111.468 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 4.5 p -161.96 131.33 4.51 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.06 0.457 . . . . 0.0 110.744 -179.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 0.532 ' C ' ' HG3' ' A' ' 4' ' ' LYS . 1.1 t80 -81.22 -9.33 59.8 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.195 179.878 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.532 ' HG3' ' C ' ' A' ' 3' ' ' TYR . 0.0 OUTLIER 33.49 75.07 0.05 Allowed 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 179.798 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.448 ' CD1' ' HB3' ' A' ' 3' ' ' TYR . 0.7 OUTLIER -109.69 -65.7 1.13 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.195 0.521 . . . . 0.0 110.676 179.368 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 19.1 mt 70.05 52.58 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.181 179.836 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 3.2 pp -128.83 1.82 5.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.78 179.763 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 3.9 p30 -156.6 36.17 0.31 Allowed 'General case' 0 C--O 1.232 0.14 0 CA-C-O 120.799 0.333 . . . . 0.0 111.122 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.408 HD21 ' N ' ' A' ' 10' ' ' LYS . 6.8 tt -85.36 -48.19 9.28 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.12 -179.742 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.463 ' HA ' ' HD3' ' A' ' 13' ' ' LYS . 3.7 tttt -52.56 -31.54 36.46 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.628 179.904 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 13.7 tt0 -87.61 -37.73 16.55 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.565 179.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.463 ' O ' ' HB1' ' A' ' 16' ' ' ALA . . . -55.86 -38.18 69.77 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.519 179.473 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.463 ' HD3' ' HA ' ' A' ' 10' ' ' LYS . 0.0 OUTLIER -85.05 -35.31 21.96 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.6 179.692 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.45 ' O ' ' CG2' ' A' ' 17' ' ' ILE . 2.3 mm-40 -58.09 -50.04 74.85 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 178.707 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -65.13 -31.05 72.05 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 177.84 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.564 ' HB2' HD13 ' A' ' 33' ' ' ILE . . . -68.22 -43.45 77.94 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 115.215 -0.902 . . . . 0.0 111.663 -179.838 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.468 HG23 ' N ' ' A' ' 18' ' ' LYS . 8.4 tp -60.31 -35.5 62.78 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.265 0 C-N-CA 120.645 -0.422 . . . . 0.0 109.875 179.933 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.468 ' N ' HG23 ' A' ' 17' ' ' ILE . 0.1 OUTLIER -72.84 -32.21 65.31 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 177.887 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.455 ' HB3' HD13 ' A' ' 50' ' ' LEU . 0.3 OUTLIER -62.2 -52.7 62.73 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.176 -0.92 . . . . 0.0 111.753 -179.797 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.495 ' HG ' HG13 ' A' ' 25' ' ' ILE . 0.2 OUTLIER -76.82 -34.45 57.9 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.878 -0.329 . . . . 0.0 110.99 -179.612 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.433 ' CG2' ' O ' ' A' ' 17' ' ' ILE . 24.1 t -61.55 -31.13 49.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 120.885 0.374 . . . . 0.0 110.199 179.386 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -90.3 -36.61 14.59 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.31 179.306 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -78.16 -14.95 59.26 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.19 179.603 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.423 ' N ' ' O ' ' A' ' 20' ' ' LEU . . . 50.47 105.3 0.01 OUTLIER Glycine 0 CA--C 1.522 0.504 0 C-N-CA 121.252 -0.499 . . . . 0.0 113.291 179.491 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.495 HG13 ' HG ' ' A' ' 20' ' ' LEU . 0.0 OUTLIER -174.76 -171.94 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.377 0 CA-C-N 117.185 0.492 . . . . 0.0 111.678 179.397 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -40.85 95.94 0.01 OUTLIER 'General case' 0 C--O 1.232 0.14 0 CA-C-N 115.911 -0.586 . . . . 0.0 112.213 -179.186 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.428 ' O ' ' N ' ' A' ' 30' ' ' ILE . 21.3 mt-10 -53.0 -25.63 12.71 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.544 179.122 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.7 tptm -46.06 -45.54 16.19 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.388 179.152 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.569 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 2.8 m-85 -61.37 -30.52 70.59 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.041 179.585 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.428 ' N ' ' O ' ' A' ' 27' ' ' GLU . 40.9 mt -62.24 -26.67 40.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 177.991 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.8 tttp -74.12 -37.13 64.19 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.629 179.386 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.569 ' HG ' ' O ' ' A' ' 29' ' ' TYR . 0.1 OUTLIER -62.38 -32.74 73.59 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 120.191 -0.604 . . . . 0.0 109.962 179.527 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.564 HD13 ' HB2' ' A' ' 16' ' ' ALA . 4.0 pt -91.85 -46.3 14.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.105 179.517 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.405 ' CB ' ' O ' ' A' ' 30' ' ' ILE . . . -60.64 -30.53 69.93 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.906 -179.576 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 34.1 t30 -83.48 -14.05 53.28 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.83 179.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.484 ' O ' ' CB ' ' A' ' 37' ' ' LYS . . . 57.61 -138.74 0.88 Allowed 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.124 179.429 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.484 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 0.0 OUTLIER 89.07 -21.5 0.14 Allowed 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 122.582 0.353 . . . . 0.0 111.131 -179.54 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.5 m -143.22 78.57 1.61 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.49 179.579 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 7.8 p -40.51 -49.07 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.396 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.714 -179.642 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -60.68 -43.22 97.97 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 179.421 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -67.5 -47.88 60.21 Favored Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.55 -0.833 . . . . 0.0 111.935 179.073 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.448 ' CG1' ' HB3' ' A' ' 13' ' ' LYS . 8.8 t -43.58 -41.47 1.47 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.226 0 CA-C-O 121.188 0.518 . . . . 0.0 110.366 179.213 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 2.4 t-105 -78.38 -32.07 48.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.178 179.391 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.8 m -79.28 -48.85 13.41 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 120.782 0.325 . . . . 0.0 110.993 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.41 ' O ' HG23 ' A' ' 49' ' ' ILE . 1.8 mt -56.92 -36.87 70.71 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.056 179.569 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.488 ' O ' HG23 ' A' ' 49' ' ' ILE . 7.4 ttpt -66.65 -60.2 2.92 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.486 179.309 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -57.71 -33.23 68.2 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.574 -179.916 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -76.35 -52.71 9.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.999 179.866 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.532 HG12 ' CB ' ' A' ' 29' ' ' TYR . 9.4 tp -59.43 -24.32 27.86 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.214 -179.83 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.455 HD13 ' HB3' ' A' ' 19' ' ' GLU . 3.2 tp -79.37 -34.34 42.09 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 178.741 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 23.0 m -59.04 -35.71 73.77 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.88 179.376 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.79 ' O ' ' CG ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -72.05 55.95 0.31 Allowed 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 121.447 0.642 . . . . 0.0 110.38 179.886 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.405 ' OG1' ' O ' ' A' ' 52' ' ' PHE . 1.2 m 165.66 -62.87 0.0 OUTLIER 'General case' 0 N--CA 1.46 0.033 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 -179.885 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 2.9 t -93.28 85.4 1.99 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.963 179.434 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -58.22 126.33 27.04 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 120.912 0.387 . . . . 0.0 110.671 -179.65 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.252 1.212 0 CA-C-O 118.387 -0.816 . . . . 0.0 110.993 179.737 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 3.0 m . . . . . 0 N--CA 1.48 1.038 0 CA-C-O 120.496 0.188 . . . . 0.0 111.432 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 19.2 p -86.32 142.82 28.23 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.319 179.757 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 30.9 p90 -113.8 32.51 5.79 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.98 -179.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -155.18 105.35 2.51 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.907 0.384 . . . . 0.0 110.749 -179.722 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 4.9 mp -153.04 101.16 2.55 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.954 179.9 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 1.8 tt -46.52 -29.1 1.04 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.84 179.917 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 26.4 tp -132.36 144.96 50.9 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.538 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . 0.422 ' O ' ' CB ' ' A' ' 12' ' ' ALA . 13.8 t-20 -158.9 41.06 0.23 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.053 -179.725 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -82.52 -48.86 10.53 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.98 0.419 . . . . 0.0 110.518 179.841 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.447 ' O ' ' HB3' ' A' ' 14' ' ' GLU . 35.7 mttt -59.38 -33.72 71.54 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.832 179.868 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.421 ' O ' ' HG2' ' A' ' 14' ' ' GLU . 2.3 mp0 -88.15 -36.55 16.78 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.056 -179.86 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.427 ' O ' ' HB2' ' A' ' 16' ' ' ALA . . . -57.41 -37.23 72.42 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.84 0.352 . . . . 0.0 110.334 179.511 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.472 ' HG2' ' N ' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -84.92 -37.38 20.61 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.773 179.678 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.472 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 4.1 pt-20 -56.56 -49.37 75.03 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 109.141 -0.688 . . . . 0.0 109.141 178.875 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.441 ' N ' ' CG ' ' A' ' 14' ' ' GLU . 0.8 OUTLIER -65.01 -31.54 72.83 Favored 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 108.774 -0.824 . . . . 0.0 108.774 177.738 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.553 ' HB3' HD12 ' A' ' 33' ' ' ILE . . . -65.09 -43.38 92.31 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.59 179.267 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.433 HG12 ' O ' ' A' ' 13' ' ' LYS . 37.1 mm -55.83 -48.26 78.5 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.207 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 178.771 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.6 pttt -60.98 -32.38 71.94 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.562 178.37 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -65.76 -52.35 51.71 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.701 179.496 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.55 -33.94 64.95 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.685 179.965 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.4 ' CG2' ' O ' ' A' ' 17' ' ' ILE . 54.4 t -64.64 -31.26 52.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 120.92 0.391 . . . . 0.0 110.169 179.219 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -88.77 -34.59 17.06 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.283 179.478 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -81.1 -15.22 56.55 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.313 179.505 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 41.73 82.67 0.02 OUTLIER Glycine 0 C--N 1.334 0.433 0 CA-C-N 116.216 -0.447 . . . . 0.0 113.846 179.362 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.453 ' CG2' ' CZ ' ' A' ' 52' ' ' PHE . 0.1 OUTLIER -146.38 -163.3 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.219 0 CA-C-N 116.709 0.254 . . . . 0.0 110.909 179.397 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -43.89 95.3 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 120.782 0.325 . . . . 0.0 111.85 -179.447 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.412 ' O ' ' N ' ' A' ' 30' ' ' ILE . 0.3 OUTLIER -52.18 -26.28 11.17 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.952 0.406 . . . . 0.0 110.561 179.415 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.5 tptm -46.69 -45.7 19.62 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-O 121.277 0.561 . . . . 0.0 110.319 179.135 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.574 ' HA ' ' HG ' ' A' ' 32' ' ' LEU . 3.6 m-85 -62.72 -31.01 71.85 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.878 179.558 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.412 ' N ' ' O ' ' A' ' 27' ' ' GLU . 1.6 tt -61.56 -26.51 39.8 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.627 178.322 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.03 -37.45 58.35 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.735 179.634 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.574 ' HG ' ' HA ' ' A' ' 29' ' ' TYR . 0.1 OUTLIER -60.52 -32.76 71.78 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 120.123 -0.631 . . . . 0.0 109.966 179.415 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.553 HD12 ' HB3' ' A' ' 16' ' ' ALA . 3.7 pt -91.76 -47.22 14.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.923 179.442 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.402 ' CB ' ' O ' ' A' ' 30' ' ' ILE . . . -59.05 -29.23 67.15 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.999 -179.558 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 -85.72 -11.35 53.88 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.26 -179.763 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.484 ' O ' ' CB ' ' A' ' 37' ' ' LYS . . . 56.88 -141.2 0.81 Allowed 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 116.774 -0.194 . . . . 0.0 111.065 179.615 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.484 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 0.0 OUTLIER 89.45 -21.33 0.14 Allowed 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 122.629 0.372 . . . . 0.0 111.34 179.978 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 9.9 m -144.05 77.72 1.56 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.676 0.274 . . . . 0.0 110.55 179.791 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.469 ' HA ' HG21 ' A' ' 42' ' ' VAL . 14.5 p -38.85 -48.44 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.405 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.703 -179.878 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.468 ' HA ' ' CH2' ' A' ' 43' ' ' TRP . 1.8 tt0 -61.39 -52.86 62.84 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.153 179.569 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -61.79 -38.47 96.01 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.323 -0.942 . . . . 0.0 112.158 179.188 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.469 HG21 ' HA ' ' A' ' 39' ' ' VAL . 22.8 t -49.24 -45.32 17.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.938 0.399 . . . . 0.0 110.503 179.372 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . 0.468 ' CH2' ' HA ' ' A' ' 40' ' ' GLU . 1.1 p90 -79.04 -25.66 43.18 Favored 'General case' 0 N--CA 1.457 -0.121 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.028 179.308 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.422 ' N ' ' CD1' ' A' ' 43' ' ' TRP . 1.3 m -79.3 -47.53 15.7 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-O 120.885 0.374 . . . . 0.0 110.862 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -61.19 -33.54 73.62 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.01 179.527 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.466 ' O ' HG23 ' A' ' 49' ' ' ILE . 17.5 ttpt -67.85 -59.6 3.17 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.395 179.422 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.52 -32.56 70.41 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.291 179.888 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -76.35 -51.95 10.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.97 179.84 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.579 ' O ' ' CD1' ' A' ' 52' ' ' PHE . 8.6 tp -59.85 -23.86 27.79 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.243 0 C-N-CA 120.691 -0.403 . . . . 0.0 111.353 -179.804 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.2 tp -79.77 -34.62 39.63 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 178.802 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.445 ' HA ' ' CG2' ' A' ' 54' ' ' VAL . 9.3 m -67.21 -17.08 64.67 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.569 -0.741 . . . . 0.0 111.826 179.514 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.579 ' CD1' ' O ' ' A' ' 49' ' ' ILE . 0.0 OUTLIER -87.85 33.1 0.72 Allowed 'General case' 0 N--CA 1.462 0.162 0 CA-C-O 121.502 0.667 . . . . 0.0 111.074 179.964 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.48 ' O ' ' N ' ' A' ' 55' ' ' THR . 2.8 m 178.32 -70.65 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.137 -0.938 . . . . 0.0 108.894 179.599 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.445 ' CG2' ' HA ' ' A' ' 51' ' ' THR . 72.5 t 60.46 -69.93 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.462 0 CA-C-N 115.478 -0.783 . . . . 0.0 111.649 178.966 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.48 ' N ' ' O ' ' A' ' 53' ' ' THR . 86.3 m -127.5 -81.42 0.6 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.829 0.347 . . . . 0.0 110.82 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 . . . . . 0 C--O 1.247 0.946 0 CA-C-O 118.23 -0.891 . . . . 0.0 110.839 -179.828 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 35.3 p . . . . . 0 N--CA 1.488 1.431 0 CA-C-O 121.436 0.636 . . . . 0.0 111.046 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 40.0 p -115.87 -54.94 2.47 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.76 -179.766 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 58.17 22.0 8.64 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.086 179.908 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -165.46 83.77 0.35 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.171 0.51 . . . . 0.0 110.813 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.4 mt -119.49 169.5 9.99 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.837 -179.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 20.2 mt -76.89 -31.93 19.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 121.286 0.565 . . . . 0.0 111.246 179.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.559 ' O ' ' CB ' ' A' ' 8' ' ' ASN . 3.7 mp -145.94 -41.86 0.21 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.192 -179.868 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . 0.559 ' CB ' ' O ' ' A' ' 7' ' ' LEU . 5.8 t-20 98.58 -0.53 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.502 0 O-C-N 123.643 0.589 . . . . 0.0 110.726 -179.58 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.406 ' HB2' ' CG2' ' A' ' 39' ' ' VAL . 7.4 tt -49.65 -47.72 49.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.275 179.511 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.459 ' HA ' ' HD3' ' A' ' 13' ' ' LYS . 0.8 OUTLIER -51.82 -32.6 32.31 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.745 179.962 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 2.6 tm0? -89.89 -29.14 18.75 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.879 179.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.97 -37.44 87.41 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.106 179.347 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.459 ' HD3' ' HA ' ' A' ' 10' ' ' LYS . 0.0 OUTLIER -85.27 -35.39 21.56 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.862 179.66 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.44 ' HB3' ' O ' ' A' ' 10' ' ' LYS . 0.1 OUTLIER -61.21 -47.34 86.54 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 179.218 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.409 ' N ' ' HG3' ' A' ' 14' ' ' GLU . 0.8 OUTLIER -65.76 -34.19 77.61 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 177.913 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.448 ' CB ' ' HB2' ' A' ' 46' ' ' LYS . . . -68.33 -36.83 79.85 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.5 179.39 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.489 HG21 ' N ' ' A' ' 18' ' ' LYS . 1.1 tp -58.19 -35.89 55.09 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.249 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 179.286 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.489 ' N ' HG21 ' A' ' 17' ' ' ILE . 19.8 mttt -75.11 -33.07 61.56 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.654 178.347 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.424 ' HB2' ' HA ' ' A' ' 16' ' ' ALA . 0.4 OUTLIER -62.2 -52.32 64.26 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.659 179.407 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.417 ' HG ' HD11 ' A' ' 25' ' ' ILE . 0.3 OUTLIER -69.93 -34.79 73.93 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.685 179.946 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.425 ' CG2' ' O ' ' A' ' 17' ' ' ILE . 37.7 t -64.78 -31.29 53.18 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.229 0 CA-C-O 120.937 0.399 . . . . 0.0 109.933 179.091 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -84.21 -38.09 21.01 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.031 179.15 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -76.79 -15.3 59.78 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.141 179.333 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.406 ' C ' HG13 ' A' ' 25' ' ' ILE . . . 41.18 90.07 0.01 OUTLIER Glycine 0 C--N 1.335 0.495 0 CA-C-N 116.211 -0.449 . . . . 0.0 113.856 179.258 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.44 ' N ' ' CD1' ' A' ' 25' ' ' ILE . 0.0 OUTLIER -155.51 -164.71 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.271 0 CA-C-O 120.713 0.292 . . . . 0.0 110.922 179.179 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -44.75 95.76 0.01 OUTLIER 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.844 -179.586 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.43 ' O ' ' N ' ' A' ' 30' ' ' ILE . 53.2 mt-10 -48.42 -26.96 2.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.674 179.432 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 12.2 tptm -44.96 -45.45 10.53 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.504 179.274 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.602 ' HA ' ' HG ' ' A' ' 32' ' ' LEU . 75.8 m-85 -61.05 -32.52 72.15 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.422 0.629 . . . . 0.0 110.128 179.614 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.438 ' O ' HG13 ' A' ' 33' ' ' ILE . 2.2 tt -61.9 -26.38 39.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.705 178.484 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.9 tppp? -75.68 -35.6 60.31 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.576 179.472 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.602 ' HG ' ' HA ' ' A' ' 29' ' ' TYR . 0.2 OUTLIER -59.77 -35.18 74.1 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 120.361 -0.536 . . . . 0.0 109.749 179.316 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.438 HG13 ' O ' ' A' ' 30' ' ' ILE . 2.9 pt -90.76 -46.33 14.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.945 179.402 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -60.51 -28.82 68.68 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.086 -179.704 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 -84.41 -12.93 53.52 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.406 -179.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.489 ' O ' ' CB ' ' A' ' 37' ' ' LYS . . . 62.7 -136.17 0.44 Allowed 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 116.86 -0.155 . . . . 0.0 110.84 179.61 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.489 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 0.0 OUTLIER 87.64 -14.86 0.42 Allowed 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 179.808 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.423 HG22 ' O ' ' A' ' 38' ' ' THR . 5.5 t -158.82 79.17 0.78 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.868 0.366 . . . . 0.0 110.635 179.388 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.406 ' CG2' ' HB2' ' A' ' 9' ' ' LEU . 10.2 p -38.65 -49.97 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.483 0 CA-C-N 115.894 -0.593 . . . . 0.0 111.753 -179.794 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -60.19 -43.09 96.19 Favored 'General case' 0 CA--C 1.52 -0.194 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 179.365 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.407 ' N ' ' O ' ' A' ' 38' ' ' THR . . . -67.66 -46.7 66.54 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.448 -0.882 . . . . 0.0 111.921 178.752 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.441 ' CG1' ' HB3' ' A' ' 13' ' ' LYS . 12.2 t -43.97 -40.99 1.65 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.197 0 CA-C-O 121.062 0.458 . . . . 0.0 110.399 179.339 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 4.6 t-105 -78.64 -32.26 47.27 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.163 179.39 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.6 m -79.14 -45.12 20.63 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.887 0.375 . . . . 0.0 110.913 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.42 ' O ' HG23 ' A' ' 49' ' ' ILE . 0.4 OUTLIER -60.06 -34.98 74.16 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.894 179.546 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.48 ' O ' HG23 ' A' ' 49' ' ' ILE . 9.7 ttpt -68.05 -61.04 2.04 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.366 179.409 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -57.03 -32.71 66.45 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.365 179.801 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -76.46 -52.82 9.09 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.811 179.772 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.553 HG12 ' CB ' ' A' ' 29' ' ' TYR . 6.2 tp -59.39 -23.86 26.45 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.32 0 C-N-CA 120.759 -0.376 . . . . 0.0 111.179 -179.895 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.414 HD11 ' HB3' ' A' ' 19' ' ' GLU . 5.4 tp -79.57 -32.54 42.04 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.19 0.519 . . . . 0.0 109.613 178.856 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 16.3 m -68.31 -20.69 64.76 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.602 -0.726 . . . . 0.0 112.049 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.614 ' O ' ' CG ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -85.11 43.78 1.03 Allowed 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 121.635 0.731 . . . . 0.0 111.185 -179.74 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.413 ' OG1' ' O ' ' A' ' 52' ' ' PHE . 5.7 m -176.18 -67.42 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.516 179.331 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 3.3 t -78.05 -71.28 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.607 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.544 179.875 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.06 101.57 0.22 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.983 0.421 . . . . 0.0 111.088 -179.759 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 . . . . . 0 C--O 1.246 0.892 0 CA-C-O 118.266 -0.874 . . . . 0.0 110.933 -179.961 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 3.0 m . . . . . 0 N--CA 1.486 1.36 0 CA-C-O 120.944 0.402 . . . . 0.0 111.188 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 34.9 p -126.89 -56.01 1.37 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.71 -179.927 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 1.2 t80 58.86 21.05 8.66 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.638 -179.449 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 5.1 ttpt -163.27 81.83 0.47 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.078 -179.86 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 4.1 mt -129.93 -56.56 1.12 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.584 -179.704 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 20.1 mt -128.17 91.91 1.79 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.377 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.905 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 4.0 tp -176.09 -38.08 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 120.618 0.247 . . . . 0.0 111.219 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 5.8 p-10 -107.73 -53.05 2.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.88 0.371 . . . . 0.0 110.871 -179.86 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.412 ' CD1' ' CG2' ' A' ' 42' ' ' VAL . 1.3 tp -69.01 -48.99 61.67 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.815 179.85 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.416 ' HA ' ' HD3' ' A' ' 13' ' ' LYS . 0.7 OUTLIER -59.39 -34.61 72.65 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.864 -179.938 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -88.5 -30.91 19.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.782 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.05 -37.75 83.75 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.085 179.321 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.499 ' O ' HG12 ' A' ' 17' ' ' ILE . 0.0 OUTLIER -85.03 -37.03 20.85 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.752 179.626 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.463 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 0.3 OUTLIER -58.45 -47.28 84.53 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 179.229 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -66.39 -33.11 74.97 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 177.837 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.561 ' HB1' HD11 ' A' ' 33' ' ' ILE . . . -64.0 -36.93 85.59 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.394 179.268 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.499 HG12 ' O ' ' A' ' 13' ' ' LYS . 4.9 mm -60.94 -50.95 78.45 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.337 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 178.697 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.29 -32.2 66.39 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.355 -0.839 . . . . 0.0 109.851 178.498 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.88 -52.47 63.99 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.081 179.694 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.413 HD22 ' CD1' ' A' ' 30' ' ' ILE . 0.2 OUTLIER -79.39 -29.58 42.13 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.756 -179.984 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.416 ' CG2' ' O ' ' A' ' 17' ' ' ILE . 65.0 t -64.91 -32.43 58.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.274 179.571 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -90.0 -38.11 13.85 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.035 179.232 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -76.24 -14.72 60.12 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.023 179.283 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 48.25 97.67 0.01 OUTLIER Glycine 0 C--N 1.332 0.344 0 C-N-CA 121.143 -0.551 . . . . 0.0 113.002 179.58 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.471 HD13 HG23 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -160.11 -166.64 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.26 0 CA-C-N 116.899 0.35 . . . . 0.0 111.125 179.734 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -47.76 94.56 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.85 -179.549 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.414 ' O ' ' N ' ' A' ' 30' ' ' ILE . 4.2 mm-40 -51.24 -26.9 7.85 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.069 0.461 . . . . 0.0 110.48 179.267 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -46.8 -44.81 19.53 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.065 178.926 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.646 ' HA ' ' HG ' ' A' ' 32' ' ' LEU . 3.5 m-85 -60.76 -31.72 71.06 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.067 179.5 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.47 HG23 HD12 ' A' ' 30' ' ' ILE . 43.2 mt -61.57 -26.53 39.85 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 CA-C-N 115.967 -0.56 . . . . 0.0 109.507 178.02 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.3 tttp -74.45 -35.92 63.35 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.477 179.399 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.646 ' HG ' ' HA ' ' A' ' 29' ' ' TYR . 0.2 OUTLIER -61.36 -33.83 74.3 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 120.377 -0.529 . . . . 0.0 109.93 179.464 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.561 HD11 ' HB1' ' A' ' 16' ' ' ALA . 2.3 pt -91.83 -46.65 14.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.831 179.506 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.402 ' CB ' ' O ' ' A' ' 30' ' ' ILE . . . -58.85 -29.56 67.03 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.889 -179.659 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 24.0 t30 -85.13 -7.07 59.24 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.218 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.51 ' O ' ' CB ' ' A' ' 37' ' ' LYS . . . 51.62 -138.74 1.04 Allowed 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 116.704 -0.225 . . . . 0.0 111.248 179.401 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.51 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 0.0 OUTLIER 93.1 -24.66 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 122.749 0.419 . . . . 0.0 111.072 -179.886 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.9 p -145.88 81.14 1.6 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.576 179.794 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.504 ' HA ' HG22 ' A' ' 42' ' ' VAL . 13.6 p -41.79 -47.59 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.36 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.691 -179.863 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.483 ' HA ' ' CD1' ' A' ' 43' ' ' TRP . 1.8 mt-10 -60.56 -41.83 95.37 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 179.461 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -72.21 -42.22 51.09 Favored Glycine 0 C--O 1.223 -0.589 0 C-N-CA 120.332 -0.937 . . . . 0.0 112.229 178.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.504 HG22 ' HA ' ' A' ' 39' ' ' VAL . 25.3 t -45.78 -44.75 4.75 Favored 'Isoleucine or valine' 0 C--O 1.232 0.182 0 CA-C-N 116.978 0.389 . . . . 0.0 110.927 179.583 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . 0.483 ' CD1' ' HA ' ' A' ' 40' ' ' GLU . 13.1 p-90 -79.23 -28.84 42.51 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.177 179.669 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.7 m -79.73 -36.73 36.93 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 120.487 -0.485 . . . . 0.0 110.948 179.856 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.415 ' O ' HG22 ' A' ' 49' ' ' ILE . 1.0 OUTLIER -68.14 -32.52 72.85 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.147 -0.479 . . . . 0.0 109.79 179.375 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.493 ' O ' HG22 ' A' ' 49' ' ' ILE . 8.2 ttpt -69.81 -61.53 1.74 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.273 179.263 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -57.3 -27.71 62.4 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.103 179.579 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -79.91 -53.58 6.63 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.733 179.715 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.538 HG12 ' CB ' ' A' ' 29' ' ' TYR . 6.3 tp -58.33 -24.45 24.72 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.129 0 C-N-CA 120.729 -0.388 . . . . 0.0 111.027 -179.954 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -80.91 -34.66 33.28 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 178.812 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 8.5 m -65.75 -15.69 63.08 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.699 179.483 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.624 ' O ' ' CG ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -88.98 36.8 0.82 Allowed 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 121.604 0.716 . . . . 0.0 111.241 -179.651 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.9 m -177.88 -69.96 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.705 179.242 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER 70.2 150.91 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.103 179.382 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 3.9 m -134.6 55.77 1.88 Allowed 'General case' 0 CA--C 1.52 -0.208 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.851 179.616 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 . . . . . 0 C--O 1.252 1.217 0 CA-C-O 118.041 -0.981 . . . . 0.0 110.986 179.924 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 1.4 p . . . . . 0 N--CA 1.495 1.791 0 CA-C-O 120.785 0.326 . . . . 0.0 111.123 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -106.41 93.84 4.82 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.671 -179.696 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 41.54 32.63 0.24 Allowed 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.225 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 3.3 ttpt -148.61 78.41 1.41 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.573 -179.881 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 7.6 mt -145.9 68.5 1.2 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.799 179.508 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 1.8 tt -178.29 141.64 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.176 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -167.27 137.54 2.95 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.25 0.548 . . . . 0.0 110.485 -179.984 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 168.31 -42.0 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.276 179.699 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.423 ' CD1' ' CG2' ' A' ' 42' ' ' VAL . 4.1 tp -57.85 -49.02 78.08 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.923 0.392 . . . . 0.0 111.296 -179.718 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 3.2 mtpt -57.46 -36.76 71.85 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.298 -179.636 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -85.12 -39.14 18.25 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.073 -179.798 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.74 -38.04 66.66 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.622 179.684 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.473 ' HB3' ' CG1' ' A' ' 42' ' ' VAL . 0.0 OUTLIER -85.03 -35.66 21.76 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.756 179.608 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.45 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 3.1 mm-40 -60.05 -50.52 73.4 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 179.075 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 68.8 tt0 -64.83 -31.81 73.22 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 178.038 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.513 ' HA ' ' HG3' ' A' ' 46' ' ' LYS . . . -65.0 -37.78 88.78 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.175 179.194 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.458 HG12 ' O ' ' A' ' 13' ' ' LYS . 20.6 mm -58.03 -46.31 87.98 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.169 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 178.398 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.69 -32.22 73.26 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.272 -0.877 . . . . 0.0 109.47 178.237 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.432 ' HB2' ' HA ' ' A' ' 16' ' ' ALA . 0.4 OUTLIER -63.64 -52.42 60.87 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.565 179.268 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.491 ' HG ' ' CD1' ' A' ' 25' ' ' ILE . 0.3 OUTLIER -70.9 -33.98 71.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.66 179.88 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 78.1 t -63.9 -31.17 52.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.908 0.385 . . . . 0.0 110.07 179.103 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -87.08 -37.89 17.0 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.244 179.371 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.41 ' O ' HG13 ' A' ' 25' ' ' ILE . . . -77.57 -15.39 59.27 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.211 179.63 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 40.19 90.27 0.01 OUTLIER Glycine 0 C--N 1.335 0.482 0 CA-C-N 116.279 -0.419 . . . . 0.0 114.057 179.267 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.491 ' CD1' ' HG ' ' A' ' 20' ' ' LEU . 0.2 OUTLIER -162.76 -167.71 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.227 0 CA-C-N 116.839 0.32 . . . . 0.0 111.138 179.06 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -33.66 95.89 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 112.398 0.518 . . . . 0.0 112.398 -179.169 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.411 ' O ' ' N ' ' A' ' 30' ' ' ILE . 0.0 OUTLIER -56.21 -25.75 48.42 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.501 179.443 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.12 -46.1 11.65 Favored 'General case' 0 C--O 1.239 0.507 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.899 179.402 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.611 ' HA ' ' HG ' ' A' ' 32' ' ' LEU . 3.3 m-85 -64.37 -30.36 71.4 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.242 0.544 . . . . 0.0 110.242 179.848 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.411 ' N ' ' O ' ' A' ' 27' ' ' GLU . 0.9 OUTLIER -62.0 -26.39 39.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.415 178.175 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.7 ttmm -75.62 -37.83 59.43 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.55 179.484 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.611 ' HG ' ' HA ' ' A' ' 29' ' ' TYR . 0.1 OUTLIER -59.24 -33.74 71.38 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 120.102 -0.639 . . . . 0.0 109.783 179.43 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.431 ' CD1' ' HB2' ' A' ' 16' ' ' ALA . 4.9 pt -90.87 -48.33 14.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.807 179.272 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -56.2 -28.89 59.92 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.886 -179.864 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -88.62 -15.95 33.7 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.946 179.755 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.468 ' O ' ' CB ' ' A' ' 37' ' ' LYS . . . 61.73 -137.7 0.51 Allowed 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.011 179.458 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.468 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 12.1 mttt 90.33 -22.86 0.1 Allowed 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 122.875 0.47 . . . . 0.0 111.23 -179.789 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -143.58 79.43 1.63 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.584 179.748 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 13.5 p -40.15 -47.72 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.595 -179.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -62.8 -43.95 97.45 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 179.427 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -66.49 -46.7 75.16 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.482 -0.866 . . . . 0.0 111.759 178.836 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.473 ' CG1' ' HB3' ' A' ' 13' ' ' LYS . 17.0 t -44.83 -41.48 2.23 Favored 'Isoleucine or valine' 0 C--O 1.234 0.248 0 CA-C-O 121.215 0.531 . . . . 0.0 110.27 179.109 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 31.7 t-105 -76.62 -31.51 57.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.957 179.098 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 m -80.53 -53.1 6.88 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.765 0.316 . . . . 0.0 110.986 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -52.86 -35.73 57.95 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.035 0.445 . . . . 0.0 109.93 179.468 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.513 ' HG3' ' HA ' ' A' ' 16' ' ' ALA . 1.2 ttmt -68.05 -59.54 3.17 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.114 179.241 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -57.71 -31.47 66.43 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.234 179.768 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -77.16 -52.59 9.0 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.891 179.795 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.571 ' O ' ' HD1' ' A' ' 52' ' ' PHE . 7.1 tp -60.78 -23.88 30.57 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-O 120.792 0.329 . . . . 0.0 111.144 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.4 ' CD2' ' HG3' ' A' ' 19' ' ' GLU . 5.4 tp -79.33 -32.95 43.5 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 178.675 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 31.6 m -61.99 -36.63 82.06 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.2 179.519 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.782 ' O ' ' CG ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -71.63 58.25 0.3 Allowed 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 121.556 0.693 . . . . 0.0 110.635 -179.882 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.429 ' OG1' ' O ' ' A' ' 52' ' ' PHE . 18.7 m -174.91 -70.45 0.01 OUTLIER 'General case' 0 C--O 1.232 0.132 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 179.653 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 2.6 t -76.51 105.96 5.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.474 179.149 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 60.65 -144.14 0.49 Allowed 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.156 179.816 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.241 -0.885 . . . . 0.0 110.899 -179.949 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 1.4 m . . . . . 0 N--CA 1.487 1.381 0 CA-C-O 120.7 0.286 . . . . 0.0 111.063 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -130.07 158.22 40.23 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.137 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 5.6 p90 -97.11 24.56 6.22 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.152 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -154.63 86.69 1.14 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.418 0.627 . . . . 0.0 111.041 179.687 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.459 ' O ' ' CB ' ' A' ' 6' ' ' ILE . 0.0 OUTLIER -128.11 -38.3 1.82 Allowed 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.073 179.989 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.459 ' CB ' ' O ' ' A' ' 5' ' ' LEU . 0.1 OUTLIER 92.11 -31.13 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 C-N-CA 123.031 0.533 . . . . 0.0 110.876 -179.315 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.1 mt 55.75 -89.5 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.37 179.279 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 73.62 32.56 1.15 Allowed 'General case' 0 C--N 1.334 -0.101 0 CA-C-O 121.454 0.645 . . . . 0.0 109.422 -178.84 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.424 ' CD1' ' N ' ' A' ' 10' ' ' LYS . 0.0 OUTLIER -73.46 -42.89 61.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.04 -0.982 . . . . 0.0 111.143 -179.266 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.424 ' N ' ' CD1' ' A' ' 9' ' ' LEU . 0.0 OUTLIER -51.96 -37.25 52.21 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.933 0.397 . . . . 0.0 111.234 -179.478 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.08 -30.31 19.99 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.142 -179.794 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.19 -37.1 85.9 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.261 179.579 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.484 ' HG2' ' N ' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -85.22 -37.69 19.81 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.948 179.701 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.484 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -56.46 -45.77 80.68 Favored 'General case' 0 C--O 1.233 0.234 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 179.068 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.405 ' N ' ' HG3' ' A' ' 14' ' ' GLU . 2.0 tp10 -68.27 -33.53 74.53 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.382 -0.826 . . . . 0.0 108.876 177.859 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.486 ' HB2' HD12 ' A' ' 33' ' ' ILE . . . -66.36 -37.41 85.24 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.317 179.54 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.412 HG12 ' O ' ' A' ' 13' ' ' LYS . 32.0 mm -58.81 -48.47 86.06 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.171 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 178.751 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.66 -32.86 73.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.691 178.5 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.416 ' HB3' HD11 ' A' ' 50' ' ' LEU . 0.3 OUTLIER -61.51 -52.41 64.61 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.549 -0.75 . . . . 0.0 111.06 179.861 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.421 ' CD1' HG12 ' A' ' 49' ' ' ILE . 0.2 OUTLIER -76.26 -34.91 59.15 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.951 -179.659 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.409 ' CG2' ' O ' ' A' ' 17' ' ' ILE . 71.3 t -63.42 -31.12 51.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 120.941 0.4 . . . . 0.0 110.374 179.528 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -91.49 -34.38 14.82 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.427 179.6 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -79.96 -15.17 57.82 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.323 179.791 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.407 ' O ' ' CG2' ' A' ' 25' ' ' ILE . . . 46.42 102.49 0.01 OUTLIER Glycine 0 CA--C 1.523 0.59 0 C-N-CA 121.315 -0.469 . . . . 0.0 113.334 179.476 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.434 ' CD1' ' CE1' ' A' ' 52' ' ' PHE . 1.1 pt -172.99 -173.4 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.21 0 CA-C-N 117.003 0.401 . . . . 0.0 111.326 179.501 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -36.84 95.14 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 -179.242 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.445 ' O ' ' N ' ' A' ' 30' ' ' ILE . 1.6 pt-20 -54.14 -25.48 22.55 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.732 179.47 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -44.52 -47.49 10.14 Favored 'General case' 0 C--O 1.239 0.522 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.593 179.303 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.616 ' HA ' ' HG ' ' A' ' 32' ' ' LEU . 2.1 m-85 -63.81 -30.46 71.55 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.237 0.541 . . . . 0.0 110.06 179.655 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.445 ' N ' ' O ' ' A' ' 27' ' ' GLU . 1.4 tt -60.81 -26.42 38.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.397 177.953 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.1 tptm -76.07 -37.55 58.11 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.593 179.515 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.616 ' HG ' ' HA ' ' A' ' 29' ' ' TYR . 0.1 OUTLIER -60.48 -32.42 71.41 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 119.885 -0.726 . . . . 0.0 109.856 179.349 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.486 HD12 ' HB2' ' A' ' 16' ' ' ALA . 4.6 pt -91.86 -48.34 13.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.851 179.456 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -58.54 -29.35 66.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.907 -179.687 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 7.8 t-20 -85.19 -17.96 35.55 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.936 179.768 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.497 ' O ' ' CB ' ' A' ' 37' ' ' LYS . . . 61.28 -143.32 0.47 Allowed 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 116.626 -0.261 . . . . 0.0 110.923 179.612 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.497 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 0.0 OUTLIER 90.18 -21.79 0.12 Allowed 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 122.633 0.373 . . . . 0.0 111.406 -179.973 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -141.39 77.02 1.57 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.683 0.277 . . . . 0.0 110.639 179.878 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.473 ' HA ' HG21 ' A' ' 42' ' ' VAL . 12.3 p -39.38 -47.04 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.63 -179.851 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.473 ' HA ' ' CZ2' ' A' ' 43' ' ' TRP . 0.4 OUTLIER -61.16 -52.69 63.76 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 179.563 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -63.35 -37.55 95.02 Favored Glycine 0 C--O 1.226 -0.372 0 C-N-CA 120.246 -0.978 . . . . 0.0 112.186 179.234 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.473 HG21 ' HA ' ' A' ' 39' ' ' VAL . 29.1 t -49.9 -44.53 21.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 121.067 0.46 . . . . 0.0 110.387 179.416 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . 0.473 ' CZ2' ' HA ' ' A' ' 40' ' ' GLU . 1.1 p90 -81.49 -24.54 36.66 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.283 179.234 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.8 m -79.98 -48.04 14.0 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-O 120.874 0.369 . . . . 0.0 110.616 179.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 2.1 mt -62.02 -32.36 72.84 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.863 179.26 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.47 ' O ' HG22 ' A' ' 49' ' ' ILE . 4.0 tttm -67.67 -60.02 2.87 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.468 179.421 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -60.58 -30.23 69.68 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.301 179.748 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 -77.22 -52.29 9.48 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.974 179.802 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.503 HD11 ' CG ' ' A' ' 29' ' ' TYR . 7.2 tp -60.25 -24.03 29.47 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.07 -179.943 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.416 HD11 ' HB3' ' A' ' 19' ' ' GLU . 3.3 tp -79.38 -32.84 43.16 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 178.469 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 50.9 m -59.66 -37.46 78.81 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.915 179.205 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.788 ' O ' ' CG ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -74.09 56.86 0.62 Allowed 'General case' 0 CA--C 1.539 0.549 0 CA-C-O 121.58 0.705 . . . . 0.0 110.536 179.813 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.432 ' OG1' ' O ' ' A' ' 52' ' ' PHE . 1.4 m 173.83 -67.26 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.147 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 179.827 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 3.0 t -83.24 -67.61 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.438 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.952 179.419 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 69.69 114.92 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.048 179.968 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.221 -0.895 . . . . 0.0 110.906 179.863 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 11.9 t . . . . . 0 N--CA 1.484 1.251 0 CA-C-O 120.809 0.337 . . . . 0.0 111.201 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -139.38 -67.04 0.45 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.668 -179.78 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 4.6 t80 58.66 25.39 13.24 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.142 0.496 . . . . 0.0 111.187 -179.696 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 13.0 ttpt -167.68 -65.53 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.001 179.925 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.2 mt 62.31 -85.12 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.119 179.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 34.7 mm 47.82 92.68 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.335 0 CA-C-O 120.564 0.221 . . . . 0.0 110.959 179.606 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -121.7 -169.29 1.84 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.035 0.445 . . . . 0.0 111.264 -179.834 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 175.75 -46.02 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.783 179.787 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 9.2 tt -67.12 -48.86 66.84 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 121.017 0.436 . . . . 0.0 110.721 179.649 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.441 ' HA ' ' HD3' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -52.21 -34.0 43.62 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.738 -0.664 . . . . 0.0 110.825 179.842 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -89.3 -29.67 19.0 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.775 179.802 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.4 -38.07 88.22 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.057 179.239 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.449 ' HB3' ' CG1' ' A' ' 42' ' ' VAL . 0.0 OUTLIER -85.41 -35.45 21.3 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.037 179.704 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.436 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 0.3 OUTLIER -59.9 -42.33 93.61 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 179.128 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.403 ' N ' ' HG3' ' A' ' 14' ' ' GLU . 1.4 tp10 -72.18 -30.93 65.45 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 177.833 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.492 ' HB1' HD12 ' A' ' 33' ' ' ILE . . . -68.67 -47.2 67.12 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.071 -0.968 . . . . 0.0 111.149 179.661 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.432 HG23 ' N ' ' A' ' 18' ' ' LYS . 0.5 OUTLIER -57.2 -39.24 65.95 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.235 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 179.145 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.432 ' N ' HG23 ' A' ' 17' ' ' ILE . 0.0 OUTLIER -68.09 -32.47 72.81 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 177.384 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.47 ' HB2' ' HA ' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -66.11 -49.59 66.99 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.478 179.152 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.498 ' HG ' HG12 ' A' ' 25' ' ' ILE . 0.2 OUTLIER -74.47 -35.75 63.28 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.948 -179.758 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.422 ' CG2' ' O ' ' A' ' 17' ' ' ILE . 44.0 t -63.4 -31.22 52.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 120.847 0.356 . . . . 0.0 110.21 179.461 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -89.51 -34.91 16.23 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.334 179.589 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -79.7 -14.97 58.37 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.355 179.779 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 46.33 97.39 0.01 OUTLIER Glycine 0 CA--C 1.522 0.506 0 C-N-CA 121.051 -0.595 . . . . 0.0 113.287 179.603 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.508 HG23 HD12 ' A' ' 25' ' ' ILE . 0.1 OUTLIER -162.09 -176.62 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.461 0.122 0 CA-C-N 116.884 0.342 . . . . 0.0 111.479 179.986 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -45.69 96.38 0.01 OUTLIER 'General case' 0 CA--C 1.518 -0.267 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.596 -179.452 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.507 ' O ' ' N ' ' A' ' 30' ' ' ILE . 19.5 mm-40 -45.62 -25.11 0.42 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.194 178.681 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -39.53 -50.59 2.19 Favored 'General case' 0 C--O 1.239 0.519 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.917 178.754 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.624 ' HA ' ' HG ' ' A' ' 32' ' ' LEU . 2.8 m-85 -65.47 -32.83 74.65 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.972 179.665 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.507 ' N ' ' O ' ' A' ' 27' ' ' GLU . 1.0 OUTLIER -59.76 -26.28 34.73 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.391 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.556 178.091 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.7 tttm -75.94 -37.81 58.28 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.455 179.494 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.624 ' HG ' ' HA ' ' A' ' 29' ' ' TYR . 0.1 OUTLIER -59.57 -33.03 70.92 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 120.18 -0.608 . . . . 0.0 109.766 179.308 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.492 HD12 ' HB1' ' A' ' 16' ' ' ALA . 3.8 pt -91.8 -45.9 14.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.967 179.573 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -58.48 -28.8 65.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.678 -179.866 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -88.62 -12.53 42.31 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.123 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.547 ' O ' ' CB ' ' A' ' 37' ' ' LYS . . . 61.45 -140.02 0.5 Allowed 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 116.734 -0.212 . . . . 0.0 110.996 179.391 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.547 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 0.0 OUTLIER 96.33 -27.41 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 122.783 0.433 . . . . 0.0 110.758 -179.786 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -144.03 83.37 1.74 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.598 179.73 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 8.8 p -40.77 -48.18 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.464 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.475 -179.879 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.86 -43.0 99.73 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.846 -0.427 . . . . 0.0 109.846 179.304 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -66.58 -46.51 75.99 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.522 -0.847 . . . . 0.0 111.762 178.879 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.449 ' CG1' ' HB3' ' A' ' 13' ' ' LYS . 10.6 t -45.29 -41.97 2.93 Favored 'Isoleucine or valine' 0 C--O 1.233 0.201 0 CA-C-O 121.287 0.565 . . . . 0.0 110.196 179.168 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 14.3 t90 -76.76 -30.28 56.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.987 179.255 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.5 m -82.43 -54.62 5.06 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.831 0.348 . . . . 0.0 111.161 -179.782 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -52.93 -32.49 45.94 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 179.306 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.49 ' O ' HG21 ' A' ' 49' ' ' ILE . 0.3 OUTLIER -70.02 -60.77 2.09 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.271 -0.877 . . . . 0.0 110.245 179.296 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -58.25 -31.91 67.86 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.196 179.656 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -75.49 -54.98 6.14 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.836 179.763 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.553 HG12 ' CB ' ' A' ' 29' ' ' TYR . 7.7 tp -56.84 -23.88 18.71 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.188 0 C-N-CA 120.705 -0.398 . . . . 0.0 111.236 -179.85 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.403 ' CD1' ' HG3' ' A' ' 19' ' ' GLU . 4.2 tp -79.04 -34.91 43.42 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 178.931 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.439 ' HA ' HG21 ' A' ' 54' ' ' VAL . 17.4 m -66.06 -18.05 65.09 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.755 179.719 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.551 ' O ' ' CG ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -88.85 34.32 0.78 Allowed 'General case' 0 CA--C 1.532 0.257 0 CA-C-O 121.467 0.651 . . . . 0.0 111.215 -179.732 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.437 ' OG1' ' O ' ' A' ' 52' ' ' PHE . 2.8 m 177.59 -67.69 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.145 -0.934 . . . . 0.0 109.202 179.488 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.439 HG21 ' HA ' ' A' ' 51' ' ' THR . 67.6 t 55.09 93.26 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.452 -0.374 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.168 179.202 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 75.4 m -122.56 75.07 1.23 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.831 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.25 1.093 0 CA-C-O 118.166 -0.921 . . . . 0.0 110.856 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.647 HD13 ' HB1' ' A' ' 36' ' ' ALA . 2.4 pp . . . . . 0 N--CA 1.458 -0.072 0 CA-C-O 120.655 0.264 . . . . 0.0 111.056 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 17.4 tttm -54.36 -38.32 65.95 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.146 0.498 . . . . 0.0 110.354 179.75 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.403 ' HA ' ' HB2' ' A' ' 14' ' ' GLU . 0.1 OUTLIER -90.43 -32.91 16.21 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.388 179.393 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.539 ' HB3' ' HA ' ' A' ' 9' ' ' LEU . . . -60.06 -38.27 82.32 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.504 179.377 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.594 ' HB3' HG11 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -85.41 -36.85 20.41 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.445 179.352 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.466 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 6.1 mm-40 -56.48 -50.45 71.73 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 178.906 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -64.17 -34.24 77.62 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 177.901 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.593 ' HB1' ' CD1' ' A' ' 33' ' ' ILE . . . -65.19 -38.87 91.83 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.4 179.391 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.722 ' O ' HG23 ' A' ' 21' ' ' VAL . 26.1 mm -55.62 -50.03 69.85 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.168 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 178.767 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -60.62 -33.18 72.4 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.736 -0.666 . . . . 0.0 109.964 178.642 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.647 ' HB3' HD13 ' A' ' 50' ' ' LEU . 0.1 OUTLIER -61.74 -52.47 64.12 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.661 179.496 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.744 HD22 ' HB ' ' A' ' 30' ' ' ILE . 0.2 OUTLIER -76.08 -34.28 59.54 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.673 179.886 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.722 HG23 ' O ' ' A' ' 17' ' ' ILE . 64.1 t -64.43 -31.2 52.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-O 120.866 0.365 . . . . 0.0 110.086 179.38 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -88.24 -35.95 17.02 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.203 179.313 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.845 ' HB3' HD11 ' A' ' 25' ' ' ILE . . . -78.84 -15.37 58.46 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.245 179.536 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 41.87 79.69 0.05 OUTLIER Glycine 0 CA--C 1.522 0.508 0 CA-C-N 116.307 -0.406 . . . . 0.0 113.799 179.451 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.845 HD11 ' HB3' ' A' ' 23' ' ' ALA . 0.1 OUTLIER -144.2 -162.63 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.233 0 CA-C-N 116.812 0.306 . . . . 0.0 110.999 179.346 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -43.25 95.45 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.185 0 CA-C-O 120.863 0.364 . . . . 0.0 111.801 -179.497 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.635 ' O ' HG22 ' A' ' 30' ' ' ILE . 0.4 OUTLIER -52.87 -26.03 13.48 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.576 179.504 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.96 -45.92 15.95 Favored 'General case' 0 C--O 1.237 0.445 0 CA-C-O 121.344 0.592 . . . . 0.0 110.294 179.223 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.826 ' CD1' HD13 ' A' ' 49' ' ' ILE . 4.0 m-85 -62.69 -31.82 72.79 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.074 179.657 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.744 ' HB ' HD22 ' A' ' 20' ' ' LEU . 1.8 tt -60.9 -26.56 39.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.0 -0.545 . . . . 0.0 109.659 178.445 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -76.62 -37.64 56.04 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.879 179.738 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.588 ' HG ' ' O ' ' A' ' 29' ' ' TYR . 0.0 OUTLIER -60.99 -32.29 71.87 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 120.034 -0.666 . . . . 0.0 109.941 179.51 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.593 ' CD1' ' HB1' ' A' ' 16' ' ' ALA . 3.9 pt -91.86 -45.99 14.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.017 179.365 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.38 -29.68 67.88 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.879 -179.732 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -87.29 -14.55 40.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.006 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.647 ' HB1' HD13 ' A' ' 9' ' ' LEU . . . 57.75 -131.71 1.36 Allowed 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.115 179.822 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.459 ' HB2' ' O ' ' A' ' 36' ' ' ALA . 0.0 OUTLIER 85.1 -19.24 0.34 Allowed 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 122.611 0.364 . . . . 0.0 111.131 -179.737 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.654 ' O ' HG23 ' A' ' 42' ' ' VAL . 0.2 OUTLIER -147.17 77.78 1.46 Allowed 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 179.583 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.521 HG13 ' N ' ' A' ' 40' ' ' GLU . 14.9 p -40.64 -49.19 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.953 -179.378 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.521 ' N ' HG13 ' A' ' 39' ' ' VAL . 0.4 OUTLIER -59.17 -42.68 91.38 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.778 -0.452 . . . . 0.0 109.778 179.373 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -69.15 -47.1 55.32 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.432 -0.889 . . . . 0.0 111.983 178.791 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.654 HG23 ' O ' ' A' ' 38' ' ' THR . 21.3 t -43.5 -41.59 1.43 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.249 0 CA-C-O 121.135 0.493 . . . . 0.0 110.538 179.322 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 39.2 t-105 -78.18 -32.16 49.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.784 -0.643 . . . . 0.0 110.988 179.512 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.8 m -78.47 -47.37 17.58 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.962 0.41 . . . . 0.0 110.992 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.71 ' O ' HG22 ' A' ' 49' ' ' ILE . 3.8 mm? -58.5 -35.1 71.7 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.228 179.525 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.451 ' HD3' ' HB2' ' A' ' 16' ' ' ALA . 1.7 ttpm? -68.12 -59.99 2.82 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.403 179.493 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.11 -31.58 69.06 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.361 179.797 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -77.42 -53.5 7.58 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 115.916 -0.583 . . . . 0.0 111.054 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.826 HD13 ' CD1' ' A' ' 29' ' ' TYR . 7.5 tp -57.01 -24.14 19.78 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.194 0 C-N-CA 120.702 -0.399 . . . . 0.0 111.203 -179.756 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.647 HD13 ' HB3' ' A' ' 19' ' ' GLU . 2.2 tp -80.13 -36.46 35.21 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 178.697 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 23.7 m -57.29 -24.64 56.24 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.622 178.831 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.577 ' CE1' HG21 ' A' ' 25' ' ' ILE . 0.0 OUTLIER . . . . . 0 CA--C 1.533 0.29 0 CA-C-O 120.811 0.338 . . . . 0.0 111.042 179.647 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.653 HD13 ' HB1' ' A' ' 36' ' ' ALA . 2.6 pp . . . . . 0 N--CA 1.455 -0.181 0 CA-C-O 120.887 0.375 . . . . 0.0 111.068 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.423 ' HA ' ' HD3' ' A' ' 13' ' ' LYS . 0.6 OUTLIER -52.22 -35.93 50.84 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.398 179.712 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 4.5 mt-30 -90.51 -32.52 16.3 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.467 179.442 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.429 ' HB3' ' HA ' ' A' ' 9' ' ' LEU . . . -60.81 -37.75 83.05 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.371 179.451 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.586 ' HB3' HG11 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -85.46 -37.47 19.71 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.419 179.466 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.476 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 5.8 mm-40 -57.77 -50.45 73.22 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 179.173 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -65.27 -32.46 74.13 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 177.964 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.547 ' HB1' ' CD1' ' A' ' 33' ' ' ILE . . . -66.97 -37.5 84.36 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.42 179.437 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.774 ' O ' HG23 ' A' ' 21' ' ' VAL . 21.0 mm -57.45 -48.21 83.3 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.14 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 178.713 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 18.4 mttt -63.59 -33.3 75.31 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.822 178.568 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.815 ' HB3' HD13 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -59.96 -52.24 66.24 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.692 179.53 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.575 HD22 ' HB ' ' A' ' 30' ' ' ILE . 0.3 OUTLIER -75.86 -32.41 59.73 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.747 -179.852 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.774 HG23 ' O ' ' A' ' 17' ' ' ILE . 53.9 t -64.3 -31.25 52.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.252 179.408 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -90.32 -38.3 13.46 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.436 179.591 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.454 ' O ' HG13 ' A' ' 25' ' ' ILE . . . -78.77 -15.55 58.28 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.438 179.797 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.721 ' O ' HG23 ' A' ' 25' ' ' ILE . . . 40.58 90.04 0.01 OUTLIER Glycine 0 C--N 1.335 0.515 0 CA-C-N 116.344 -0.389 . . . . 0.0 113.739 179.381 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.721 HG23 ' O ' ' A' ' 24' ' ' GLY . 0.4 OUTLIER -176.2 136.2 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.227 0 CA-C-O 121.072 0.463 . . . . 0.0 111.707 179.445 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . 38.11 89.97 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 115.616 -0.72 . . . . 0.0 112.558 179.696 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.634 ' O ' HG22 ' A' ' 30' ' ' ILE . 0.0 OUTLIER -62.82 -29.38 70.69 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.283 0.563 . . . . 0.0 109.637 178.557 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 2.6 tptt -46.08 -45.19 16.07 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.481 179.11 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.58 ' HA ' ' HG ' ' A' ' 32' ' ' LEU . 3.6 m-85 -64.0 -31.63 72.88 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.085 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.634 HG22 ' O ' ' A' ' 27' ' ' GLU . 1.6 tt -60.94 -26.19 38.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.732 178.322 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 12.7 tttt -77.89 -37.58 47.67 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.057 179.729 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.629 ' HB2' HD13 ' A' ' 45' ' ' LEU . 0.0 OUTLIER -60.69 -32.07 71.31 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 120.214 -0.594 . . . . 0.0 109.839 179.688 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.547 ' CD1' ' HB1' ' A' ' 16' ' ' ALA . 5.0 pt -91.7 -45.83 14.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.986 179.47 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.404 ' HB2' HD11 ' A' ' 17' ' ' ILE . . . -60.35 -29.09 68.67 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.003 -179.799 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 -86.47 -15.8 39.04 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.253 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.653 ' HB1' HD13 ' A' ' 9' ' ' LEU . . . 59.22 -139.4 0.72 Allowed 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 116.662 -0.245 . . . . 0.0 110.893 179.634 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.527 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 1.4 tptt 94.81 -26.71 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 122.688 0.395 . . . . 0.0 110.855 -179.691 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.667 ' O ' HG23 ' A' ' 42' ' ' VAL . 1.2 m -142.95 82.45 1.76 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.461 179.588 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.526 HG23 ' HB3' ' A' ' 9' ' ' LEU . 11.5 p -41.29 -47.66 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.568 -179.484 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.514 ' N ' HG13 ' A' ' 39' ' ' VAL . 1.8 mt-10 -60.39 -43.92 96.15 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.877 -0.416 . . . . 0.0 109.877 179.292 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.634 ' O ' ' HG ' ' A' ' 45' ' ' LEU . . . -67.91 -47.23 61.61 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 120.424 -0.893 . . . . 0.0 111.948 178.815 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.667 HG23 ' O ' ' A' ' 38' ' ' THR . 21.9 t -43.72 -41.52 1.56 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.259 0 CA-C-O 121.177 0.513 . . . . 0.0 110.584 179.195 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 37.0 t90 -78.59 -30.88 46.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.086 179.497 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.8 m -78.88 -44.93 21.74 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 120.722 0.296 . . . . 0.0 111.105 -179.887 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.703 ' O ' HG22 ' A' ' 49' ' ' ILE . 1.2 mt -61.86 -34.13 75.43 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.044 179.572 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.469 ' HG3' ' HA ' ' A' ' 16' ' ' ALA . 1.2 ttpt -68.38 -60.72 2.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.473 179.539 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -58.08 -30.51 66.28 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.247 179.713 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.61 -54.0 6.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.922 179.769 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.703 HG22 ' O ' ' A' ' 45' ' ' LEU . 5.3 tp -57.67 -24.06 21.68 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.141 0 C-N-CA 120.9 -0.32 . . . . 0.0 111.193 -179.892 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.815 HD13 ' HB3' ' A' ' 19' ' ' GLU . 4.3 tp -80.29 -35.86 35.21 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 178.998 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 17.3 m -66.26 -15.91 63.59 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.788 179.695 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.537 ' CG ' ' O ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER . . . . . 0 N--CA 1.462 0.165 0 CA-C-O 121.158 0.504 . . . . 0.0 111.509 -179.478 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.795 HD13 ' HB1' ' A' ' 36' ' ' ALA . 2.6 pp . . . . . 0 N--CA 1.457 -0.089 0 CA-C-O 120.84 0.352 . . . . 0.0 111.073 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.431 ' HA ' ' HD3' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -50.85 -37.91 46.01 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.092 0.473 . . . . 0.0 110.627 -179.958 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.0 -32.77 16.62 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.536 179.787 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.425 ' HB3' ' HA ' ' A' ' 9' ' ' LEU . . . -60.91 -37.52 82.56 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.498 179.46 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.531 ' HB3' HG11 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -85.35 -37.54 19.79 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.477 179.371 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.479 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 2.8 mm-40 -56.86 -50.56 72.1 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 178.947 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -64.33 -34.69 78.74 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 177.977 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.519 ' HB1' ' CD1' ' A' ' 33' ' ' ILE . . . -64.46 -37.98 89.41 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.225 179.286 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.817 ' O ' HG23 ' A' ' 21' ' ' VAL . 23.6 mm -56.3 -47.53 81.0 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.158 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 178.689 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 18.2 mttp -62.86 -33.27 74.92 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.912 178.684 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.584 ' CG ' HD13 ' A' ' 50' ' ' LEU . 0.6 OUTLIER -61.42 -52.31 65.12 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.636 179.549 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.746 HD22 ' HB ' ' A' ' 30' ' ' ILE . 0.2 OUTLIER -72.51 -35.03 68.02 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.772 -179.963 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.817 HG23 ' O ' ' A' ' 17' ' ' ILE . 70.2 t -63.27 -31.17 51.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 120.809 0.338 . . . . 0.0 110.244 179.36 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -88.86 -36.09 16.18 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.463 179.508 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.745 ' HB3' HD11 ' A' ' 25' ' ' ILE . . . -78.32 -15.42 58.74 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.341 179.715 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.402 ' C ' HG13 ' A' ' 25' ' ' ILE . . . 41.34 90.43 0.01 OUTLIER Glycine 0 CA--C 1.524 0.612 0 C-N-CA 121.507 -0.378 . . . . 0.0 113.792 179.44 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.745 HD11 ' HB3' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -156.32 -163.54 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 CA-C-N 116.649 0.224 . . . . 0.0 110.915 179.387 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -45.17 95.07 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 120.823 0.344 . . . . 0.0 111.699 -179.613 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.565 ' O ' HG22 ' A' ' 30' ' ' ILE . 7.8 mt-10 -52.24 -25.64 9.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.778 179.455 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -45.38 -46.81 13.42 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.593 179.402 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.642 ' HA ' ' HG ' ' A' ' 32' ' ' LEU . 1.1 m-85 -62.46 -30.42 71.23 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.283 0.563 . . . . 0.0 109.919 179.706 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.746 ' HB ' HD22 ' A' ' 20' ' ' LEU . 1.3 tt -60.81 -26.25 37.91 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.361 0 CA-C-N 115.778 -0.646 . . . . 0.0 109.361 177.941 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.42 -37.2 57.41 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.64 179.607 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.642 ' HG ' ' HA ' ' A' ' 29' ' ' TYR . 0.1 OUTLIER -59.82 -33.89 72.35 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 120.068 -0.653 . . . . 0.0 109.813 179.359 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.519 ' CD1' ' HB1' ' A' ' 16' ' ' ALA . 4.2 pt -90.78 -46.71 14.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.966 179.541 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.408 ' HB2' HD11 ' A' ' 17' ' ' ILE . . . -57.6 -28.64 63.81 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.774 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 16.6 t-20 -89.43 -15.72 32.54 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.944 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.795 ' HB1' HD13 ' A' ' 9' ' ' LEU . . . 59.08 -134.95 0.89 Allowed 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 116.67 -0.241 . . . . 0.0 110.964 179.633 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.492 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 5.6 ttmm 89.98 -22.61 0.11 Allowed 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 122.699 0.4 . . . . 0.0 111.145 -179.894 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.657 ' O ' HG23 ' A' ' 42' ' ' VAL . 1.2 m -145.67 79.0 1.56 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.396 179.675 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.513 HG13 ' N ' ' A' ' 40' ' ' GLU . 10.0 p -39.54 -48.54 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.426 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.641 -179.63 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.513 ' N ' HG13 ' A' ' 39' ' ' VAL . 3.1 mt-10 -58.08 -45.72 86.66 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 179.369 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -69.13 -43.59 71.09 Favored Glycine 0 N--CA 1.447 -0.594 0 C-N-CA 120.408 -0.901 . . . . 0.0 112.182 178.844 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.657 HG23 ' O ' ' A' ' 38' ' ' THR . 23.7 t -43.27 -46.69 1.49 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.175 0 CA-C-O 120.879 0.371 . . . . 0.0 110.834 179.696 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.491 ' CZ2' ' HA ' ' A' ' 40' ' ' GLU . 1.1 p90 -78.47 -27.52 46.33 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 120.612 -0.435 . . . . 0.0 110.979 179.277 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.434 ' N ' ' CD1' ' A' ' 43' ' ' TRP . 3.2 m -76.62 -49.28 16.64 Favored 'General case' 0 N--CA 1.463 0.184 0 C-N-CA 120.75 -0.38 . . . . 0.0 110.839 179.825 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.699 ' O ' HG22 ' A' ' 49' ' ' ILE . 3.6 mt -59.79 -33.07 71.23 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.224 179.585 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.415 ' HD2' ' HA ' ' A' ' 16' ' ' ALA . 6.7 ttpt -67.97 -59.0 3.6 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.359 179.562 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -60.66 -31.71 70.92 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.241 179.689 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -76.23 -52.64 9.61 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.931 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.699 HG22 ' O ' ' A' ' 45' ' ' LEU . 7.4 tp -58.43 -23.97 23.83 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.257 0 C-N-CA 120.784 -0.367 . . . . 0.0 111.16 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.584 HD13 ' CG ' ' A' ' 19' ' ' GLU . 1.5 tp -79.24 -34.94 42.3 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 178.549 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 34.3 m -61.26 -24.32 66.3 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.313 179.238 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.58 ' CE1' HG21 ' A' ' 25' ' ' ILE . 0.0 OUTLIER . . . . . 0 CA--C 1.533 0.296 0 CA-C-O 120.914 0.388 . . . . 0.0 111.179 -179.88 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.524 ' HB3' HG23 ' A' ' 39' ' ' VAL . 3.0 pp . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.909 0.385 . . . . 0.0 110.627 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.435 ' HA ' ' HD3' ' A' ' 13' ' ' LYS . 0.7 OUTLIER -53.61 -37.8 63.38 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.247 179.55 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.408 ' HA ' ' HB2' ' A' ' 14' ' ' GLU . 1.7 tt0 -89.88 -32.64 16.78 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.347 179.441 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.482 ' HB3' ' HA ' ' A' ' 9' ' ' LEU . . . -59.88 -38.28 81.76 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.321 179.371 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.579 ' HB3' HG11 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -85.46 -35.16 21.4 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.636 179.394 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.848 ' O ' HG22 ' A' ' 17' ' ' ILE . 2.1 mm-40 -60.43 -50.44 73.57 Favored 'General case' 0 C--O 1.234 0.263 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 179.049 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -64.41 -34.49 78.3 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 178.026 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.505 ' HB1' ' CD1' ' A' ' 33' ' ' ILE . . . -67.26 -36.34 81.4 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 115.177 -0.919 . . . . 0.0 110.436 179.587 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.848 HG22 ' O ' ' A' ' 14' ' ' GLU . 1.8 tp -59.9 -33.55 53.06 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.209 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 179.18 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 4.5 mttp -76.7 -33.21 58.23 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.583 178.348 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.582 ' CG ' HD13 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -59.05 -52.44 65.72 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.677 179.419 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.734 HD22 ' HB ' ' A' ' 30' ' ' ILE . 0.3 OUTLIER -71.41 -35.86 71.13 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.895 -179.842 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.744 HG23 ' O ' ' A' ' 17' ' ' ILE . 41.1 t -62.33 -31.28 51.18 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-O 120.982 0.42 . . . . 0.0 110.119 179.28 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -88.58 -35.27 16.99 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.96 179.14 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -77.12 -15.19 59.64 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.17 179.45 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 39.66 85.93 0.01 OUTLIER Glycine 0 CA--C 1.521 0.449 0 CA-C-N 116.235 -0.439 . . . . 0.0 113.905 179.358 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.649 HD12 ' HG ' ' A' ' 20' ' ' LEU . 0.8 OUTLIER -163.41 -171.18 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 CA-C-N 116.716 0.258 . . . . 0.0 111.118 179.15 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.409 ' O ' HD21 ' A' ' 20' ' ' LEU . . . -28.78 95.73 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -179.096 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.616 ' O ' HG22 ' A' ' 30' ' ' ILE . 0.3 OUTLIER -58.96 -25.54 63.65 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.464 179.46 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -44.15 -46.6 8.84 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.681 179.473 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.934 ' CG ' HD13 ' A' ' 49' ' ' ILE . 3.5 m-85 -62.39 -31.24 71.88 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.291 0.567 . . . . 0.0 110.169 179.743 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.734 ' HB ' HD22 ' A' ' 20' ' ' LEU . 1.9 tt -60.79 -26.28 37.94 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.485 178.149 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 13.9 tttt -76.54 -37.13 57.14 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.704 179.632 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.618 ' HG ' ' HA ' ' A' ' 29' ' ' TYR . 0.1 OUTLIER -60.73 -32.67 71.93 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 120.095 -0.642 . . . . 0.0 109.834 179.494 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.505 ' CD1' ' HB1' ' A' ' 16' ' ' ALA . 5.1 pt -91.5 -45.62 14.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.966 179.444 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.56 -28.94 67.56 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.868 -179.823 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 20.6 t30 -87.97 -14.37 39.34 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.174 -179.917 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.533 ' O ' ' CB ' ' A' ' 37' ' ' LYS . . . 57.28 -139.42 0.88 Allowed 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 116.738 -0.21 . . . . 0.0 111.085 179.553 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.533 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 0.9 OUTLIER 95.44 -27.38 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 122.843 0.457 . . . . 0.0 110.734 -179.752 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.652 ' O ' HG23 ' A' ' 42' ' ' VAL . 1.0 OUTLIER -142.25 82.89 1.81 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.3 179.564 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.524 HG23 ' HB3' ' A' ' 9' ' ' LEU . 14.8 p -41.83 -47.21 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.307 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.658 -179.64 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.511 ' N ' HG13 ' A' ' 39' ' ' VAL . 0.0 OUTLIER -60.2 -43.29 96.04 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 179.254 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -68.87 -46.96 58.04 Favored Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.481 -0.866 . . . . 0.0 112.008 178.791 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.652 HG23 ' O ' ' A' ' 38' ' ' THR . 21.7 t -43.88 -41.88 1.7 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-O 121.135 0.493 . . . . 0.0 110.518 179.18 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 64.1 t-105 -77.71 -31.69 52.45 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.094 179.438 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.8 m -78.61 -44.6 23.56 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 120.748 0.309 . . . . 0.0 111.085 -179.831 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.689 ' O ' HG22 ' A' ' 49' ' ' ILE . 3.8 mm? -60.58 -35.07 75.19 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.083 179.479 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.447 ' CD ' ' HB2' ' A' ' 16' ' ' ALA . 0.8 OUTLIER -68.24 -60.38 2.51 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.459 179.554 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -59.47 -29.73 68.03 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.322 179.739 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -78.14 -54.24 6.47 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.974 179.851 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.934 HD13 ' CG ' ' A' ' 29' ' ' TYR . 8.6 tp -56.1 -24.32 17.48 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 C-N-CA 120.828 -0.349 . . . . 0.0 111.061 -179.735 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.582 HD13 ' CG ' ' A' ' 19' ' ' GLU . 1.2 tp -81.07 -35.7 31.4 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 178.526 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 7.5 m -55.58 -27.37 48.87 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.244 178.724 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.603 ' HD2' ' O ' ' A' ' 49' ' ' ILE . 0.0 OUTLIER . . . . . 0 CA--C 1.531 0.223 0 CA-C-O 120.874 0.369 . . . . 0.0 110.27 178.836 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.765 HD13 ' HB1' ' A' ' 36' ' ' ALA . 3.1 pp . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.741 0.305 . . . . 0.0 110.912 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 7.7 tttm -52.03 -38.84 58.33 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.032 0.444 . . . . 0.0 110.514 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.28 -33.2 18.13 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.445 179.553 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.452 ' HB3' ' HA ' ' A' ' 9' ' ' LEU . . . -59.64 -37.54 78.94 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.584 179.465 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.578 ' HB3' HG11 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -85.42 -35.97 20.96 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.526 179.425 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.46 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 23.9 mt-10 -57.04 -50.41 72.84 Favored 'General case' 0 C--O 1.237 0.403 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 178.915 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -63.96 -33.89 76.75 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 177.666 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.581 ' HB1' ' CD1' ' A' ' 33' ' ' ILE . . . -64.55 -38.49 91.18 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.205 179.246 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.875 ' O ' HG23 ' A' ' 21' ' ' VAL . 26.7 mm -56.12 -52.49 50.01 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.13 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 178.823 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.38 -33.06 70.73 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.845 178.58 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.556 ' CG ' HD13 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -59.95 -52.24 66.23 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.382 179.324 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.776 HD22 ' HB ' ' A' ' 30' ' ' ILE . 0.3 OUTLIER -72.74 -32.31 65.58 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.418 179.748 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.875 HG23 ' O ' ' A' ' 17' ' ' ILE . 87.9 t -62.6 -32.11 54.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 120.904 0.383 . . . . 0.0 110.276 179.328 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.407 ' OD2' ' HA ' ' A' ' 19' ' ' GLU . 1.5 p30 -88.19 -40.12 13.95 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.28 179.412 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.32 -15.28 60.96 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.178 179.424 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.421 ' C ' HG13 ' A' ' 25' ' ' ILE . . . 37.57 89.55 0.01 OUTLIER Glycine 0 CA--C 1.522 0.525 0 CA-C-N 116.121 -0.491 . . . . 0.0 114.036 179.296 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.703 HD12 ' HG ' ' A' ' 20' ' ' LEU . 0.5 OUTLIER -159.08 -168.83 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.214 0 CA-C-N 116.653 0.227 . . . . 0.0 111.058 179.285 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -33.47 95.73 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -179.269 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.655 ' O ' HG22 ' A' ' 30' ' ' ILE . 1.3 mp0 -54.41 -25.68 26.16 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.562 179.562 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.4 tptt -44.57 -46.37 9.94 Favored 'General case' 0 C--O 1.238 0.489 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.608 179.519 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.579 ' HA ' ' HG ' ' A' ' 32' ' ' LEU . 3.3 m-85 -62.97 -31.66 72.82 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.189 0.518 . . . . 0.0 110.209 179.819 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.776 ' HB ' HD22 ' A' ' 20' ' ' LEU . 2.0 tt -60.61 -26.17 37.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.683 178.347 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 7.1 tptt -77.44 -37.67 51.13 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.884 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.579 ' HG ' ' HA ' ' A' ' 29' ' ' TYR . 0.0 OUTLIER -60.96 -31.88 71.43 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 120.044 -0.662 . . . . 0.0 110.027 179.583 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.581 ' CD1' ' HB1' ' A' ' 16' ' ' ALA . 3.2 pt -91.72 -46.05 14.4 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.938 179.371 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -58.75 -28.87 66.31 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.953 -179.888 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 16.6 t-20 -89.12 -13.54 38.27 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.058 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.765 ' HB1' HD13 ' A' ' 9' ' ' LEU . . . 58.14 -136.32 0.95 Allowed 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 116.69 -0.232 . . . . 0.0 111.054 179.643 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.529 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 24.2 tttt 94.8 -26.86 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 122.767 0.427 . . . . 0.0 110.718 -179.701 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.649 ' O ' HG23 ' A' ' 42' ' ' VAL . 0.2 OUTLIER -144.4 83.17 1.71 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.31 179.673 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.505 HG13 ' N ' ' A' ' 40' ' ' GLU . 12.9 p -41.34 -47.52 0.79 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.651 -179.598 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.505 ' N ' HG13 ' A' ' 39' ' ' VAL . 0.4 OUTLIER -60.6 -43.27 97.61 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 179.194 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.581 ' O ' ' HG ' ' A' ' 45' ' ' LEU . . . -67.75 -46.52 67.27 Favored Glycine 0 N--CA 1.448 -0.567 0 C-N-CA 120.526 -0.845 . . . . 0.0 111.884 178.774 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.649 HG23 ' O ' ' A' ' 38' ' ' THR . 20.7 t -45.19 -39.63 2.25 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 CA-C-O 121.171 0.51 . . . . 0.0 110.494 179.281 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 1.9 t90 -79.56 -30.41 41.67 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.87 179.336 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.7 m -78.93 -48.25 14.92 Favored 'General case' 0 C--N 1.334 -0.084 0 CA-C-O 120.892 0.377 . . . . 0.0 110.836 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.746 ' O ' HG22 ' A' ' 49' ' ' ILE . 1.5 mt -59.3 -34.7 72.62 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.145 179.564 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.484 ' HD3' ' HB2' ' A' ' 16' ' ' ALA . 3.5 ttpp -68.51 -59.02 3.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.416 179.495 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.02 -30.1 67.76 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.223 179.676 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -78.04 -54.32 6.41 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.847 179.713 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.746 HG22 ' O ' ' A' ' 45' ' ' LEU . 4.1 tp -56.6 -23.93 18.15 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.208 0 C-N-CA 120.858 -0.337 . . . . 0.0 110.923 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.556 HD13 ' CG ' ' A' ' 19' ' ' GLU . 3.4 tp -80.74 -33.52 35.06 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 178.525 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 38.1 m -60.13 -26.34 66.19 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.617 -0.72 . . . . 0.0 111.199 179.462 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.759 ' CG ' ' O ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.537 0.466 0 CA-C-O 121.466 0.651 . . . . 0.0 111.01 -179.803 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.757 HD13 ' HB1' ' A' ' 36' ' ' ALA . 3.1 pp . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.813 0.339 . . . . 0.0 110.977 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.43 ' HA ' ' HD3' ' A' ' 13' ' ' LYS . 12.4 tttp -50.66 -37.38 40.54 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.571 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.97 -29.26 18.58 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.703 179.705 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.99 -38.25 90.41 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.172 179.298 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.562 ' HB3' HG11 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -85.6 -35.26 21.13 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.06 179.725 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.74 ' O ' HG22 ' A' ' 17' ' ' ILE . 0.4 OUTLIER -59.15 -43.96 92.07 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.58 0.705 . . . . 0.0 109.238 179.035 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -70.75 -31.08 67.76 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.442 -0.799 . . . . 0.0 108.973 177.941 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.595 ' HB1' ' CD1' ' A' ' 33' ' ' ILE . . . -70.42 -41.82 72.42 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 115.217 -0.901 . . . . 0.0 111.307 -179.743 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.74 HG22 ' O ' ' A' ' 14' ' ' GLU . 0.8 OUTLIER -60.09 -35.51 61.91 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.285 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 179.305 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -70.48 -32.5 70.04 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 108.979 -0.749 . . . . 0.0 108.979 177.54 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.612 ' HG3' HD13 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -63.44 -52.53 61.08 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.16 -0.927 . . . . 0.0 111.266 179.801 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.454 ' HG ' HG13 ' A' ' 25' ' ' ILE . 0.2 OUTLIER -77.45 -35.18 54.16 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.192 -179.461 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.566 HG23 ' O ' ' A' ' 17' ' ' ILE . 37.1 t -65.22 -31.01 52.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 120.883 0.373 . . . . 0.0 110.298 179.57 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 23.2 m-20 -91.12 -33.18 15.56 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.7 179.747 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -83.8 -14.96 50.13 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.526 179.863 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.425 ' C ' ' CG1' ' A' ' 25' ' ' ILE . . . 55.18 112.46 0.01 OUTLIER Glycine 0 CA--C 1.523 0.586 0 C-N-CA 121.071 -0.585 . . . . 0.0 112.951 179.481 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.562 HG21 ' CE1' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -178.82 -173.69 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.357 0 CA-C-N 117.165 0.482 . . . . 0.0 111.407 179.478 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -43.77 94.56 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.133 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.832 -179.421 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.585 ' O ' HG22 ' A' ' 30' ' ' ILE . 3.0 mt-10 -50.86 -26.74 6.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.528 179.347 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -46.67 -46.33 19.9 Favored 'General case' 0 C--O 1.238 0.483 0 CA-C-O 121.325 0.584 . . . . 0.0 110.211 179.055 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.701 ' CG ' HD13 ' A' ' 49' ' ' ILE . 3.0 m-85 -62.08 -32.13 72.64 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 121.41 0.624 . . . . 0.0 109.767 179.413 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.585 HG22 ' O ' ' A' ' 27' ' ' GLU . 1.2 tt -60.59 -26.25 37.2 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.659 178.31 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.4 ttpt -76.2 -36.56 58.56 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.606 179.471 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.89 ' HB2' HD23 ' A' ' 45' ' ' LEU . 0.2 OUTLIER -59.73 -34.03 72.4 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 120.394 -0.523 . . . . 0.0 109.76 179.188 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.601 HG22 ' HA ' ' A' ' 42' ' ' VAL . 2.9 pt -91.82 -45.56 14.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.959 179.6 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.67 -29.41 68.04 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.771 -179.836 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 30.7 t30 -87.39 -12.68 45.55 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.031 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.757 ' HB1' HD13 ' A' ' 9' ' ' LEU . . . 59.28 -134.31 0.9 Allowed 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.062 179.675 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.52 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 1.0 OUTLIER 92.9 -40.59 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 122.79 0.436 . . . . 0.0 110.537 -179.686 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.612 ' O ' HG23 ' A' ' 42' ' ' VAL . 13.8 p -129.97 82.47 2.07 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.25 179.476 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.536 HG13 ' N ' ' A' ' 40' ' ' GLU . 12.6 p -41.69 -49.14 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.358 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.772 -179.63 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.536 ' N ' HG13 ' A' ' 39' ' ' VAL . 0.1 OUTLIER -58.34 -41.83 85.52 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 179.168 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -68.96 -47.67 53.03 Favored Glycine 0 N--CA 1.448 -0.554 0 C-N-CA 120.609 -0.805 . . . . 0.0 111.982 178.811 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.612 HG23 ' O ' ' A' ' 38' ' ' THR . 17.4 t -42.84 -40.78 1.04 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.192 0 CA-C-O 121.191 0.52 . . . . 0.0 110.493 179.23 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 68.0 t-105 -79.21 -32.89 44.12 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.199 179.342 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.6 m -79.79 -49.62 11.75 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-O 120.997 0.427 . . . . 0.0 111.021 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.89 HD23 ' HB2' ' A' ' 32' ' ' LEU . 0.4 OUTLIER -56.81 -34.97 68.21 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.033 179.428 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.447 ' HG3' ' HA ' ' A' ' 16' ' ' ALA . 3.5 tttm -68.54 -60.21 2.59 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.4 179.341 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -57.98 -32.27 67.73 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.415 179.714 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -76.18 -53.49 8.2 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.08 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.71 HG22 ' O ' ' A' ' 45' ' ' LEU . 7.3 tp -57.38 -24.28 21.24 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.171 0 C-N-CA 120.649 -0.42 . . . . 0.0 111.265 -179.777 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.612 HD13 ' HG3' ' A' ' 19' ' ' GLU . 2.2 tp -79.24 -35.84 40.91 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 178.794 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 44.1 m -59.31 -25.44 64.16 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.011 178.984 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.562 ' CE1' HG21 ' A' ' 25' ' ' ILE . 0.0 OUTLIER . . . . . 0 CA--C 1.532 0.284 0 CA-C-O 120.924 0.392 . . . . 0.0 111.042 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.77 HD13 ' HB1' ' A' ' 36' ' ' ALA . 3.4 pp . . . . . 0 C--O 1.23 0.029 0 CA-C-O 120.891 0.377 . . . . 0.0 111.027 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.47 -38.3 53.14 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.734 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.44 -29.12 20.43 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.783 179.691 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.67 -37.05 85.87 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.198 179.466 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.586 ' HB3' HG11 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -85.27 -37.81 19.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.75 179.54 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.48 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -56.97 -46.73 81.98 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 179.101 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.404 ' N ' ' HG3' ' A' ' 14' ' ' GLU . 6.8 tp10 -66.42 -36.06 81.86 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 177.952 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.532 ' HA ' ' HG3' ' A' ' 46' ' ' LYS . . . -64.22 -39.76 94.64 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 115.147 -0.933 . . . . 0.0 110.193 179.368 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.727 HD13 HG12 ' A' ' 30' ' ' ILE . 25.7 mm -54.39 -46.91 70.29 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.167 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 178.57 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 24.3 mmtm -62.01 -33.23 73.95 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.717 178.366 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.547 ' HG3' HD13 ' A' ' 50' ' ' LEU . 0.5 OUTLIER -62.04 -52.53 63.59 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.613 179.55 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.704 HD22 ' HB ' ' A' ' 30' ' ' ILE . 0.2 OUTLIER -76.86 -34.4 57.82 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.942 -179.818 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.708 HG23 ' O ' ' A' ' 17' ' ' ILE . 52.8 t -63.08 -31.24 51.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 120.866 0.365 . . . . 0.0 110.188 179.535 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -90.26 -35.37 15.34 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.6 179.513 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.415 ' O ' ' O ' ' A' ' 24' ' ' GLY . . . -79.02 -15.26 58.48 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.4 179.732 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.872 ' O ' HG23 ' A' ' 25' ' ' ILE . . . 44.37 105.9 0.01 OUTLIER Glycine 0 CA--C 1.526 0.758 0 N-CA-C 114.243 0.457 . . . . 0.0 114.243 179.009 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.872 HG23 ' O ' ' A' ' 24' ' ' GLY . 1.7 pp -176.41 -170.86 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 CA-C-N 116.823 0.312 . . . . 0.0 110.556 178.646 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -35.91 94.97 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.325 0 N-CA-C 112.225 0.454 . . . . 0.0 112.225 -179.387 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.618 ' O ' HG22 ' A' ' 30' ' ' ILE . 4.7 pt-20 -54.55 -25.38 25.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.67 179.572 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -43.08 -47.68 6.06 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.928 179.457 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.669 ' HA ' ' HG ' ' A' ' 32' ' ' LEU . 3.4 m-85 -63.12 -32.75 74.21 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.292 0.568 . . . . 0.0 110.092 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.727 HG12 HD13 ' A' ' 17' ' ' ILE . 1.4 tt -59.71 -26.27 34.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.67 178.295 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.5 tppp? -76.83 -37.06 56.36 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.637 179.583 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.896 ' HB2' HD23 ' A' ' 45' ' ' LEU . 0.2 OUTLIER -58.95 -34.06 71.32 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 120.299 -0.56 . . . . 0.0 109.802 179.379 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.607 HG22 ' HA ' ' A' ' 42' ' ' VAL . 3.0 pt -91.68 -45.88 14.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.882 179.378 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.513 ' HB2' HD11 ' A' ' 17' ' ' ILE . . . -57.99 -28.89 64.8 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.747 179.961 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 11.0 t-20 -88.05 -15.99 34.83 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.079 179.894 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.77 ' HB1' HD13 ' A' ' 9' ' ' LEU . . . 60.31 -137.84 0.65 Allowed 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.985 179.596 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.516 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 2.9 tppt? 93.69 -26.0 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 122.753 0.421 . . . . 0.0 110.87 -179.523 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.676 ' O ' HG23 ' A' ' 42' ' ' VAL . 10.2 m -142.55 81.61 1.74 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.401 179.566 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.506 HG13 ' N ' ' A' ' 40' ' ' GLU . 12.3 p -41.95 -47.32 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.349 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.588 -179.693 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.506 ' N ' HG13 ' A' ' 39' ' ' VAL . 0.1 OUTLIER -60.27 -42.43 95.4 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 179.3 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.6 ' H ' HG22 ' A' ' 38' ' ' THR . . . -69.85 -47.59 46.59 Favored Glycine 0 N--CA 1.448 -0.546 0 C-N-CA 120.506 -0.854 . . . . 0.0 111.949 178.86 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.676 HG23 ' O ' ' A' ' 38' ' ' THR . 17.0 t -43.14 -41.97 1.24 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.163 0 CA-C-O 121.134 0.492 . . . . 0.0 110.548 179.239 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 2.6 t-105 -77.17 -32.65 56.34 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.762 -0.653 . . . . 0.0 111.02 179.325 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.7 m -80.52 -52.14 7.96 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 120.815 0.341 . . . . 0.0 111.072 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.896 HD23 ' HB2' ' A' ' 32' ' ' LEU . 0.4 OUTLIER -53.64 -34.2 57.76 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.922 179.445 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.532 ' HG3' ' HA ' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -69.17 -60.64 2.21 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.02 179.233 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -57.76 -30.82 65.93 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.169 179.659 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -77.01 -52.74 8.82 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.103 179.701 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.73 HG22 ' O ' ' A' ' 45' ' ' LEU . 4.9 tp -57.12 -24.09 20.0 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.22 0 C-N-CA 120.589 -0.444 . . . . 0.0 111.054 -179.846 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.547 HD13 ' HG3' ' A' ' 19' ' ' GLU . 1.5 tp -80.09 -35.14 37.32 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 178.735 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 50.2 m -57.68 -27.85 63.26 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.74 178.982 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.555 ' C ' ' CD1' ' A' ' 52' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.531 0.225 0 CA-C-O 120.782 0.325 . . . . 0.0 110.918 179.636 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.788 ' HG ' HG21 ' A' ' 42' ' ' VAL . 4.6 tt . . . . . 0 N--CA 1.451 -0.379 0 CA-C-O 120.843 0.354 . . . . 0.0 111.18 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -54.5 -36.67 64.45 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.51 179.769 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -87.04 -32.33 20.05 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.381 179.511 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.64 -37.24 78.14 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.481 179.408 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.624 ' HB3' HG11 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -85.1 -36.65 21.0 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.478 179.593 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.478 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 1.9 mm-40 -58.39 -50.39 73.86 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 178.949 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 56.5 tt0 -63.36 -34.55 77.97 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 177.786 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.564 ' CB ' HD12 ' A' ' 33' ' ' ILE . . . -63.57 -36.39 83.64 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 115.153 -0.93 . . . . 0.0 110.173 179.239 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.787 ' O ' HG23 ' A' ' 21' ' ' VAL . 20.4 mm -57.75 -49.17 81.73 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.139 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 178.762 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 20.4 mmtt -61.3 -33.14 73.08 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.97 178.651 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.594 ' HG3' HD13 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -59.01 -52.45 65.72 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.622 179.56 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.66 HD21 ' O ' ' A' ' 25' ' ' ILE . 0.2 OUTLIER -76.16 -29.81 57.87 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.537 179.772 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.787 HG23 ' O ' ' A' ' 17' ' ' ILE . 66.5 t -67.54 -31.2 51.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.959 0.409 . . . . 0.0 110.095 179.355 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -90.22 -33.84 16.03 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.191 179.423 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -84.66 -15.01 46.87 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.2 179.466 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.732 ' O ' HG23 ' A' ' 25' ' ' ILE . . . 40.4 86.19 0.01 OUTLIER Glycine 0 C--N 1.334 0.444 0 CA-C-N 116.299 -0.409 . . . . 0.0 113.645 179.576 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.732 HG23 ' O ' ' A' ' 24' ' ' GLY . 1.2 pp -172.66 138.54 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 CA-C-O 121.058 0.456 . . . . 0.0 112.033 179.53 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . 35.82 86.83 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 115.575 -0.739 . . . . 0.0 112.75 179.769 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.677 ' O ' HG22 ' A' ' 30' ' ' ILE . 1.3 mt-10 -61.66 -28.58 69.49 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.164 0.507 . . . . 0.0 109.669 178.606 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -45.92 -45.8 15.66 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.639 179.06 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.624 ' HA ' ' HG ' ' A' ' 32' ' ' LEU . 3.4 m-85 -65.58 -30.07 70.75 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.156 0.503 . . . . 0.0 110.284 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.677 HG22 ' O ' ' A' ' 27' ' ' GLU . 1.9 tt -61.8 -26.21 39.19 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 178.079 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.2 tppp? -76.33 -38.06 56.48 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.676 179.588 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.624 ' HG ' ' HA ' ' A' ' 29' ' ' TYR . 0.1 OUTLIER -59.72 -33.57 71.8 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 120.117 -0.633 . . . . 0.0 109.92 179.445 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.564 HD12 ' CB ' ' A' ' 16' ' ' ALA . 4.7 pt -90.18 -48.41 14.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.795 179.397 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -56.28 -28.07 57.48 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.95 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 20.9 t30 -91.54 -15.57 28.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.159 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.725 ' CB ' HD21 ' A' ' 9' ' ' LEU . . . 60.58 -162.81 0.26 Allowed 'General case' 0 C--N 1.333 -0.11 0 CA-C-O 120.499 0.19 . . . . 0.0 111.005 179.673 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.564 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 6.3 tttt 138.14 -52.97 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 123.786 0.834 . . . . 0.0 109.081 -179.478 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.66 ' O ' HG23 ' A' ' 42' ' ' VAL . 1.0 OUTLIER -129.24 101.74 6.14 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.333 -0.849 . . . . 0.0 109.847 178.946 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.542 ' N ' HD12 ' A' ' 9' ' ' LEU . 10.4 p -42.39 -38.09 0.77 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.326 0 CA-C-O 121.301 0.572 . . . . 0.0 110.81 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -69.84 -44.99 68.77 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.469 -0.787 . . . . 0.0 109.701 179.239 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -63.75 -45.16 95.08 Favored Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 120.349 -0.929 . . . . 0.0 111.335 178.745 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.788 HG21 ' HG ' ' A' ' 9' ' ' LEU . 11.7 t -48.18 -41.84 10.57 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-O 121.194 0.521 . . . . 0.0 110.008 178.919 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 48.2 t90 -77.34 -27.81 52.85 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.529 -0.76 . . . . 0.0 111.097 179.379 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.8 m -80.8 -48.84 11.9 Favored 'General case' 0 C--N 1.334 -0.107 0 CA-C-O 120.814 0.34 . . . . 0.0 111.035 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.731 ' O ' HG22 ' A' ' 49' ' ' ILE . 4.0 mm? -58.61 -34.75 71.49 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.103 179.56 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.456 ' HD2' ' HB2' ' A' ' 16' ' ' ALA . 12.2 tttm -68.46 -59.89 2.83 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.63 -0.713 . . . . 0.0 110.305 179.379 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -58.47 -31.03 67.44 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.361 179.681 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -77.1 -53.12 8.18 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.835 -0.621 . . . . 0.0 111.081 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.731 HG22 ' O ' ' A' ' 45' ' ' LEU . 4.6 tp -57.49 -23.91 20.77 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.143 0 C-N-CA 120.824 -0.35 . . . . 0.0 111.179 -179.872 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.594 HD13 ' HG3' ' A' ' 19' ' ' GLU . 2.0 tp -81.69 -32.34 31.75 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.692 -0.484 . . . . 0.0 109.692 178.782 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 17.0 m -64.79 -23.74 67.34 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.706 179.767 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.602 ' CD1' HD12 ' A' ' 49' ' ' ILE . 0.0 OUTLIER . . . . . 0 N--CA 1.464 0.263 0 CA-C-O 121.245 0.545 . . . . 0.0 111.351 179.871 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.726 HD21 ' CB ' ' A' ' 36' ' ' ALA . 6.5 tt . . . . . 0 N--CA 1.45 -0.438 0 CA-C-O 120.825 0.345 . . . . 0.0 111.43 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 4.9 mtpt -52.92 -37.79 61.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.8 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -87.52 -29.13 21.56 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.861 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.58 -36.62 84.39 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.196 179.497 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.699 ' O ' HD13 ' A' ' 17' ' ' ILE . 0.0 OUTLIER -85.27 -36.38 20.92 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.903 179.549 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.462 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 5.4 pt-20 -59.87 -50.11 75.08 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 179.159 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.443 ' N ' ' CG ' ' A' ' 14' ' ' GLU . 1.1 tp10 -65.0 -36.32 84.04 Favored 'General case' 0 CA--C 1.516 -0.345 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 178.183 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.458 ' HB1' HD13 ' A' ' 33' ' ' ILE . . . -64.45 -34.29 77.86 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 115.234 -0.893 . . . . 0.0 110.308 179.461 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.751 ' O ' HG23 ' A' ' 21' ' ' VAL . 1.3 mp -59.81 -45.83 94.37 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.277 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 178.808 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 11.3 mttt -65.46 -33.07 75.09 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.56 -0.746 . . . . 0.0 109.966 178.629 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.597 ' HG3' HD13 ' A' ' 50' ' ' LEU . 0.5 OUTLIER -56.88 -52.58 64.57 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.315 179.996 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.883 HD22 HG13 ' A' ' 30' ' ' ILE . 0.2 OUTLIER -77.63 -32.76 53.63 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.768 0.318 . . . . 0.0 110.711 -179.859 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.751 HG23 ' O ' ' A' ' 17' ' ' ILE . 55.6 t -62.82 -31.39 52.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-O 120.87 0.367 . . . . 0.0 110.203 179.464 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -90.82 -36.98 13.91 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.2 179.368 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -77.07 -14.92 59.75 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.072 179.367 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.408 ' N ' ' O ' ' A' ' 20' ' ' LEU . . . 49.71 100.99 0.01 OUTLIER Glycine 0 CA--C 1.523 0.533 0 C-N-CA 121.185 -0.531 . . . . 0.0 113.274 179.447 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.564 HG21 ' CE1' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -168.84 -169.55 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.253 0 CA-C-N 117.029 0.415 . . . . 0.0 111.403 179.345 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -43.24 95.33 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.006 -0.543 . . . . 0.0 112.143 -179.401 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.415 ' O ' ' N ' ' A' ' 30' ' ' ILE . 0.6 OUTLIER -52.61 -25.9 11.97 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.292 0.568 . . . . 0.0 110.513 179.107 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.4 ' O ' ' HB3' ' A' ' 31' ' ' LYS . 1.9 tptm -46.3 -44.91 17.01 Favored 'General case' 0 C--O 1.238 0.493 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.168 179.067 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.79 ' CG ' HD13 ' A' ' 49' ' ' ILE . 2.7 m-85 -61.46 -31.8 71.78 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.003 179.72 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.883 HG13 HD22 ' A' ' 20' ' ' LEU . 43.6 mt -60.65 -26.47 38.06 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.331 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 177.97 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.4 ' HB3' ' O ' ' A' ' 28' ' ' LYS . 0.1 OUTLIER -74.98 -37.32 61.94 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.694 179.429 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.607 ' HG ' ' HA ' ' A' ' 29' ' ' TYR . 0.1 OUTLIER -60.52 -33.37 72.55 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 120.03 -0.668 . . . . 0.0 109.841 179.55 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.636 HG22 ' HA ' ' A' ' 42' ' ' VAL . 3.7 pt -91.72 -46.69 14.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.987 179.619 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.447 ' HB2' HD11 ' A' ' 17' ' ' ILE . . . -58.71 -29.51 66.73 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.741 -179.949 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 -85.06 -12.91 51.96 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.921 179.841 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.726 ' CB ' HD21 ' A' ' 9' ' ' LEU . . . 58.59 -139.9 0.76 Allowed 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 116.656 -0.247 . . . . 0.0 110.97 179.445 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.545 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 0.4 OUTLIER 95.68 -27.12 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 122.797 0.439 . . . . 0.0 110.796 -179.855 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.707 ' O ' HG23 ' A' ' 42' ' ' VAL . 55.5 p -143.65 83.14 1.75 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.624 179.671 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.644 ' CA ' HD12 ' A' ' 9' ' ' LEU . 8.1 p -40.63 -48.85 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.494 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.531 ' N ' HG13 ' A' ' 39' ' ' VAL . 30.0 mm-40 -61.58 -41.45 97.43 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.283 -0.417 . . . . 0.0 109.957 179.61 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -68.03 -47.12 61.56 Favored Glycine 0 N--CA 1.448 -0.555 0 C-N-CA 120.519 -0.848 . . . . 0.0 111.788 178.733 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.707 HG23 ' O ' ' A' ' 38' ' ' THR . 11.9 t -43.8 -41.9 1.65 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.164 0 CA-C-O 121.276 0.56 . . . . 0.0 110.254 179.026 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 73.7 t-105 -78.3 -31.26 48.76 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.549 -0.751 . . . . 0.0 111.304 179.333 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.9 m -79.12 -49.2 12.98 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.84 0.352 . . . . 0.0 110.959 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.687 ' O ' HG22 ' A' ' 49' ' ' ILE . 1.8 mt -56.88 -34.9 68.32 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.064 -0.516 . . . . 0.0 109.928 179.459 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.447 ' HB2' ' CB ' ' A' ' 16' ' ' ALA . 12.8 tttm -67.87 -59.82 2.99 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.479 179.486 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.74 -32.64 69.41 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.497 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -76.19 -53.65 7.96 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.918 179.885 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.79 HD13 ' CG ' ' A' ' 29' ' ' TYR . 9.1 tp -58.41 -24.4 24.85 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.152 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.162 -179.73 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.597 HD13 ' HG3' ' A' ' 19' ' ' GLU . 4.1 tp -78.87 -34.54 44.86 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 178.753 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 35.6 m -58.35 -34.82 71.07 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.913 179.354 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.794 ' CG ' ' O ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.541 0.613 0 CA-C-O 121.577 0.703 . . . . 0.0 110.76 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.744 HD21 ' CB ' ' A' ' 36' ' ' ALA . 4.0 tt . . . . . 0 N--CA 1.451 -0.382 0 CA-C-O 120.862 0.363 . . . . 0.0 110.643 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.454 ' N ' HD23 ' A' ' 9' ' ' LEU . 3.7 mtmp? -54.18 -32.68 56.18 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.562 179.641 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.429 ' O ' ' HG2' ' A' ' 14' ' ' GLU . 0.8 OUTLIER -87.7 -32.94 18.93 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.55 179.551 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.62 -36.75 76.95 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.269 179.368 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.637 ' HB3' HG11 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -85.04 -37.99 19.71 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.592 179.406 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.489 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 4.5 pt-20 -56.36 -49.56 74.07 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 178.902 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.424 ' N ' ' CG ' ' A' ' 14' ' ' GLU . 60.4 tt0 -63.38 -34.01 76.8 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 177.64 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.605 ' HB1' ' CD1' ' A' ' 33' ' ' ILE . . . -63.71 -39.53 94.52 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 115.143 -0.935 . . . . 0.0 109.968 179.073 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.773 ' O ' HG23 ' A' ' 21' ' ' VAL . 28.8 mm -55.61 -49.69 72.12 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.2 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 178.523 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.6 -32.15 70.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.304 -0.862 . . . . 0.0 109.695 178.399 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.648 ' CG ' HD13 ' A' ' 50' ' ' LEU . 0.2 OUTLIER -65.97 -52.47 49.29 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.637 179.533 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.733 HD22 ' HB ' ' A' ' 30' ' ' ILE . 0.3 OUTLIER -71.74 -32.97 68.31 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.392 179.768 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.773 HG23 ' O ' ' A' ' 17' ' ' ILE . 65.4 t -63.87 -31.44 53.18 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.207 0 CA-C-N 116.311 -0.404 . . . . 0.0 109.973 179.113 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -85.19 -38.4 19.03 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.946 179.199 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.754 ' CB ' HD11 ' A' ' 25' ' ' ILE . . . -76.1 -15.09 60.16 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.968 179.267 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.412 ' C ' HG13 ' A' ' 25' ' ' ILE . . . 39.81 89.8 0.01 OUTLIER Glycine 0 CA--C 1.523 0.552 0 CA-C-N 116.144 -0.48 . . . . 0.0 114.243 179.019 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.754 HD11 ' CB ' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -153.43 -167.65 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.268 0 CA-C-N 116.78 0.29 . . . . 0.0 110.702 179.028 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.446 ' HB3' ' CE2' ' A' ' 29' ' ' TYR . . . -46.65 97.22 0.01 OUTLIER 'General case' 0 C--O 1.232 0.149 0 CA-C-O 120.927 0.394 . . . . 0.0 111.344 -179.6 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.588 ' O ' HG22 ' A' ' 30' ' ' ILE . 0.2 OUTLIER -45.28 -25.43 0.38 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.268 179.574 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -40.95 -48.23 3.13 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 121.436 0.636 . . . . 0.0 110.839 179.463 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.594 ' HA ' ' HG ' ' A' ' 32' ' ' LEU . 58.1 m-85 -60.63 -33.65 73.09 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.14 179.87 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.733 ' HB ' HD22 ' A' ' 20' ' ' LEU . 1.8 tt -60.39 -26.29 36.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.641 -0.709 . . . . 0.0 109.676 178.392 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.32 -36.88 58.07 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.761 179.598 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.617 HD12 HD12 ' A' ' 45' ' ' LEU . 0.1 OUTLIER -58.88 -33.9 71.03 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 120.229 -0.588 . . . . 0.0 109.634 179.315 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.605 ' CD1' ' HB1' ' A' ' 16' ' ' ALA . 2.5 pt -91.75 -46.43 14.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.723 179.266 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -58.44 -29.5 66.18 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.757 -179.794 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 25.6 t30 -84.95 -16.32 41.39 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.015 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.744 ' CB ' HD21 ' A' ' 9' ' ' LEU . . . 59.07 -136.93 0.81 Allowed 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.137 179.505 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.539 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 25.0 tttt 95.29 -27.32 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 122.851 0.46 . . . . 0.0 110.667 -179.478 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.66 ' O ' HG23 ' A' ' 42' ' ' VAL . 60.1 p -142.25 83.68 1.84 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.332 179.522 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.533 HG13 ' N ' ' A' ' 40' ' ' GLU . 8.6 p -39.57 -49.45 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.566 -179.726 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.533 ' N ' HG13 ' A' ' 39' ' ' VAL . 0.1 OUTLIER -61.62 -43.17 99.35 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.873 -0.418 . . . . 0.0 109.873 179.289 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -65.75 -46.13 84.94 Favored Glycine 0 N--CA 1.447 -0.568 0 C-N-CA 120.447 -0.883 . . . . 0.0 111.724 178.923 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.66 HG23 ' O ' ' A' ' 38' ' ' THR . 14.6 t -45.44 -41.6 3.09 Favored 'Isoleucine or valine' 0 C--O 1.233 0.217 0 CA-C-O 121.126 0.489 . . . . 0.0 110.261 179.048 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 69.1 t90 -77.2 -30.57 54.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.0 179.382 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.4 m -79.39 -49.15 12.8 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 120.804 0.335 . . . . 0.0 110.91 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.759 ' O ' HG22 ' A' ' 49' ' ' ILE . 3.5 mm? -56.78 -36.03 69.38 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.239 179.4 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.521 ' HD3' ' HB2' ' A' ' 16' ' ' ALA . 15.5 ttpp -67.83 -58.85 3.89 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.604 179.523 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.48 -32.37 68.7 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.293 179.789 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 17.1 tt0 -77.22 -53.52 7.63 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.981 179.815 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.759 HG22 ' O ' ' A' ' 45' ' ' LEU . 3.6 tp -56.61 -23.97 18.26 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.289 0 C-N-CA 120.902 -0.319 . . . . 0.0 111.217 -179.773 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.648 HD13 ' CG ' ' A' ' 19' ' ' GLU . 1.8 tp -81.65 -33.32 31.41 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 178.766 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 17.1 m -64.43 -18.52 64.81 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.66 179.41 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.574 ' CD1' ' O ' ' A' ' 49' ' ' ILE . 0.0 OUTLIER . . . . . 0 CA--C 1.531 0.223 0 CA-C-O 121.338 0.589 . . . . 0.0 111.361 -179.709 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.728 HD21 ' CB ' ' A' ' 36' ' ' ALA . 6.8 tt . . . . . 0 N--CA 1.451 -0.406 0 CA-C-O 120.941 0.4 . . . . 0.0 111.118 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.425 ' HA ' ' HD3' ' A' ' 13' ' ' LYS . 45.9 tttp -52.79 -35.34 56.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.901 179.874 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.406 ' O ' ' HG3' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -87.37 -32.85 19.37 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.62 179.825 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.91 -37.99 77.91 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.314 179.344 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.664 ' HB3' HG11 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -85.38 -35.4 21.38 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.784 -0.643 . . . . 0.0 111.021 179.754 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.619 ' O ' HG22 ' A' ' 17' ' ' ILE . 0.3 OUTLIER -58.52 -42.18 87.12 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 121.505 0.669 . . . . 0.0 109.299 179.086 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -72.75 -31.1 64.67 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.311 -0.859 . . . . 0.0 108.89 177.864 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.691 ' HB1' ' CD1' ' A' ' 33' ' ' ILE . . . -69.63 -42.44 74.32 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.184 -0.917 . . . . 0.0 111.335 179.903 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.683 ' O ' HG23 ' A' ' 21' ' ' VAL . 2.2 tp -61.6 -37.35 77.69 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.243 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 179.085 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.64 -32.46 71.16 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 177.491 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.59 ' CG ' HD13 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -62.03 -52.68 63.0 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.999 179.479 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.506 ' HG ' HG13 ' A' ' 25' ' ' ILE . 0.2 OUTLIER -74.95 -35.02 62.13 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.133 -179.442 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.683 HG23 ' O ' ' A' ' 17' ' ' ILE . 41.8 t -63.58 -31.25 52.24 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-O 120.838 0.351 . . . . 0.0 110.284 179.493 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -91.69 -33.12 15.18 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.638 179.571 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.419 ' O ' ' O ' ' A' ' 24' ' ' GLY . . . -82.48 -15.05 53.91 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.579 179.858 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.714 ' O ' HG23 ' A' ' 25' ' ' ILE . . . 48.76 105.02 0.01 OUTLIER Glycine 0 CA--C 1.524 0.643 0 C-N-CA 121.136 -0.554 . . . . 0.0 113.104 179.607 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.714 HG23 ' O ' ' A' ' 24' ' ' GLY . 0.7 OUTLIER -177.43 -173.67 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.199 0 CA-C-N 117.213 0.506 . . . . 0.0 111.709 179.715 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -37.03 95.15 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 115.964 -0.562 . . . . 0.0 112.358 -179.15 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.438 ' O ' ' N ' ' A' ' 30' ' ' ILE . 9.8 tt0 -54.92 -25.36 28.76 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.559 179.143 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.8 tptm -44.63 -47.94 10.46 Favored 'General case' 0 C--O 1.239 0.51 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.699 179.389 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.611 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 2.7 m-85 -64.34 -30.39 71.44 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.278 0.561 . . . . 0.0 109.855 179.582 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.63 ' CD1' HD12 ' A' ' 17' ' ' ILE . 0.6 OUTLIER -61.58 -26.4 39.51 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 CA-C-N 115.846 -0.615 . . . . 0.0 109.402 178.056 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -75.88 -38.06 58.25 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.73 179.524 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.735 ' HB2' HD13 ' A' ' 45' ' ' LEU . 0.0 OUTLIER -61.02 -32.0 71.61 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 119.962 -0.695 . . . . 0.0 109.876 179.528 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.691 ' CD1' ' HB1' ' A' ' 16' ' ' ALA . 4.1 pt -91.7 -46.47 14.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.986 179.334 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -58.74 -29.03 66.41 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.807 -179.735 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -89.15 -16.43 31.42 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.963 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.728 ' CB ' HD21 ' A' ' 9' ' ' LEU . . . 62.52 -139.98 0.42 Allowed 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 116.682 -0.236 . . . . 0.0 111.007 179.603 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.537 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 0.0 OUTLIER 95.83 -27.63 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 122.818 0.447 . . . . 0.0 110.712 -179.73 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.692 ' O ' HG23 ' A' ' 42' ' ' VAL . 0.2 OUTLIER -140.88 83.14 1.87 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.435 179.618 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.52 HG13 ' N ' ' A' ' 40' ' ' GLU . 9.2 p -40.93 -48.64 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.4 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.501 -179.849 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.52 ' N ' HG13 ' A' ' 39' ' ' VAL . 0.6 OUTLIER -62.11 -41.11 97.89 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 179.533 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -67.7 -47.11 63.43 Favored Glycine 0 N--CA 1.448 -0.511 0 C-N-CA 120.483 -0.865 . . . . 0.0 111.84 178.896 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.692 HG23 ' O ' ' A' ' 38' ' ' THR . 7.4 t -45.12 -40.43 2.32 Favored 'Isoleucine or valine' 0 C--O 1.232 0.139 0 CA-C-O 121.23 0.538 . . . . 0.0 110.198 179.161 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 60.8 t-105 -77.98 -31.52 50.8 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.985 179.186 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.8 m -78.66 -53.7 6.89 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.867 0.365 . . . . 0.0 110.988 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.737 ' O ' HG22 ' A' ' 49' ' ' ILE . 3.3 mt -55.14 -34.47 63.79 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.307 179.66 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.434 ' HB2' ' HB2' ' A' ' 16' ' ' ALA . 4.9 tttm -67.48 -58.64 4.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.229 179.446 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -60.5 -30.16 69.54 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.392 179.792 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -78.5 -53.15 7.53 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.109 179.847 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.737 HG22 ' O ' ' A' ' 45' ' ' LEU . 4.4 tp -55.69 -24.14 15.96 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.122 0 C-N-CA 120.961 -0.296 . . . . 0.0 110.912 -179.906 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.59 HD13 ' CG ' ' A' ' 19' ' ' GLU . 0.7 OUTLIER -82.39 -33.45 28.71 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 178.523 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 24.2 m -59.21 -24.93 63.56 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.13 179.172 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.579 ' CG ' ' O ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.535 0.378 0 CA-C-O 121.139 0.495 . . . . 0.0 111.078 179.94 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.718 HD21 ' CB ' ' A' ' 36' ' ' ALA . 8.9 tt . . . . . 0 N--CA 1.456 -0.132 0 CA-C-O 121.003 0.43 . . . . 0.0 111.272 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.471 ' HA ' ' HD3' ' A' ' 13' ' ' LYS . 1.3 ttpp -52.89 -35.32 57.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.957 -179.852 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.89 -29.15 19.84 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.872 -179.988 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.34 -37.59 87.87 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.143 179.374 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.573 ' HB3' HG11 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -85.42 -35.49 21.26 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.96 179.712 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.799 ' O ' HG22 ' A' ' 17' ' ' ILE . 0.3 OUTLIER -60.03 -44.91 94.3 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.43 0.633 . . . . 0.0 109.312 179.206 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.4 ' N ' ' HG3' ' A' ' 14' ' ' GLU . 0.9 OUTLIER -70.18 -31.05 68.34 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.531 -0.758 . . . . 0.0 109.05 177.967 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.567 ' HB1' ' CD1' ' A' ' 33' ' ' ILE . . . -71.19 -38.32 72.09 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.221 -0.9 . . . . 0.0 111.329 -179.886 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.799 HG22 ' O ' ' A' ' 14' ' ' GLU . 1.7 tp -63.51 -34.87 70.13 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.289 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 179.338 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.5 mmmp? -72.26 -32.32 66.55 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 109.082 -0.71 . . . . 0.0 109.082 177.667 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.511 ' HB3' HD13 ' A' ' 50' ' ' LEU . 0.5 OUTLIER -63.77 -52.72 59.08 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.22 -0.9 . . . . 0.0 111.076 179.745 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.704 HD22 ' HB ' ' A' ' 30' ' ' ILE . 0.2 OUTLIER -73.93 -35.82 64.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.212 -179.52 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.626 HG23 ' O ' ' A' ' 17' ' ' ILE . 33.0 t -63.29 -31.17 51.79 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-O 120.833 0.349 . . . . 0.0 110.32 179.552 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -90.04 -34.08 16.08 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.506 179.605 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.449 ' HB3' HD11 ' A' ' 25' ' ' ILE . . . -80.23 -15.12 57.71 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.534 179.723 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.597 ' O ' HG23 ' A' ' 25' ' ' ILE . . . 46.09 94.81 0.01 OUTLIER Glycine 0 CA--C 1.522 0.471 0 C-N-CA 121.001 -0.619 . . . . 0.0 113.237 179.724 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.738 ' N ' HD13 ' A' ' 25' ' ' ILE . 0.1 OUTLIER -160.63 -172.15 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.333 -0.13 0 CA-C-N 116.752 0.276 . . . . 0.0 111.239 179.87 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -41.47 94.75 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.948 -179.607 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.567 ' O ' HG22 ' A' ' 30' ' ' ILE . 0.0 OUTLIER -50.88 -25.61 4.76 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.623 179.59 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -45.89 -46.95 16.17 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-O 121.303 0.573 . . . . 0.0 110.548 179.195 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.68 ' HA ' ' HG ' ' A' ' 32' ' ' LEU . 3.0 m-85 -64.19 -29.78 70.87 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.279 0.562 . . . . 0.0 109.895 179.688 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.704 ' HB ' HD22 ' A' ' 20' ' ' LEU . 1.0 OUTLIER -62.38 -26.44 40.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.379 177.934 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -75.3 -36.05 61.19 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.403 179.373 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.68 ' HG ' ' HA ' ' A' ' 29' ' ' TYR . 0.2 OUTLIER -60.4 -34.66 74.24 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 120.263 -0.575 . . . . 0.0 109.826 179.146 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.567 ' CD1' ' HB1' ' A' ' 16' ' ' ALA . 5.5 pt -89.99 -46.33 15.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.943 179.414 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -61.11 -29.62 69.87 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.952 -179.46 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 33.1 t30 -84.99 -20.84 29.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.017 179.9 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.718 ' CB ' HD21 ' A' ' 9' ' ' LEU . . . 63.37 -140.01 0.35 Allowed 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.976 179.609 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.495 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 1.5 tpmp? 90.14 -22.38 0.11 Allowed 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 122.607 0.363 . . . . 0.0 111.221 -179.76 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.715 ' O ' HG23 ' A' ' 42' ' ' VAL . 0.8 OUTLIER -143.37 79.03 1.62 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.586 -0.279 . . . . 0.0 110.617 179.611 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.621 ' CA ' HD12 ' A' ' 9' ' ' LEU . 11.6 p -38.8 -49.05 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.445 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.767 -179.681 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.531 ' N ' HG13 ' A' ' 39' ' ' VAL . 0.2 OUTLIER -59.72 -47.53 85.27 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 179.511 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.47 ' O ' HD23 ' A' ' 45' ' ' LEU . . . -66.62 -40.25 94.02 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.412 -0.899 . . . . 0.0 112.452 179.269 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.715 HG23 ' O ' ' A' ' 38' ' ' THR . 21.4 t -47.07 -48.65 8.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 117.114 0.457 . . . . 0.0 110.56 179.627 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.467 ' CD1' ' HA ' ' A' ' 40' ' ' GLU . 15.4 p-90 -77.27 -26.16 52.15 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.444 179.617 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.8 m -79.68 -42.16 25.33 Favored 'General case' 0 N--CA 1.462 0.167 0 C-N-CA 120.599 -0.44 . . . . 0.0 110.983 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.725 ' O ' HG22 ' A' ' 49' ' ' ILE . 3.8 mm? -62.64 -33.77 75.71 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.133 -0.485 . . . . 0.0 109.846 179.405 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.463 ' HA ' HG22 ' A' ' 49' ' ' ILE . 8.6 ttpt -68.89 -62.12 1.52 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.229 179.292 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -55.7 -28.79 57.58 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.343 179.752 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -80.03 -54.72 5.52 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-N 115.828 -0.623 . . . . 0.0 110.713 179.589 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.725 HG22 ' O ' ' A' ' 45' ' ' LEU . 7.0 tp -58.69 -23.99 24.68 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.187 0 CA-C-O 120.86 0.362 . . . . 0.0 110.856 179.839 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.511 HD13 ' HB3' ' A' ' 19' ' ' GLU . 2.3 tp -80.3 -33.42 37.61 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.268 -0.642 . . . . 0.0 109.268 178.375 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 29.3 m -58.21 -29.71 65.91 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.783 179.085 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.627 ' HD1' ' O ' ' A' ' 49' ' ' ILE . 0.0 OUTLIER . . . . . 0 CA--C 1.535 0.384 0 CA-C-O 120.89 0.376 . . . . 0.0 111.037 179.576 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 1.057 HD23 HG21 ' A' ' 42' ' ' VAL . 0.1 OUTLIER . . . . . 0 N--CA 1.453 -0.307 0 CA-C-O 121.056 0.455 . . . . 0.0 110.696 . . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.817 ' N ' HD13 ' A' ' 9' ' ' LEU . 0.0 OUTLIER -56.82 -35.29 68.61 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.017 -179.969 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.3 -38.07 16.6 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.937 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.37 -37.42 70.04 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.645 179.623 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.666 ' HB3' HG11 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -85.19 -35.38 21.69 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.679 179.587 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.454 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 3.0 mm-40 -59.44 -50.43 73.97 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 179.059 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -63.77 -36.83 85.19 Favored 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 108.925 -0.768 . . . . 0.0 108.925 178.033 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.541 ' HB1' HD13 ' A' ' 33' ' ' ILE . . . -64.21 -35.04 79.5 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-N 115.092 -0.958 . . . . 0.0 110.346 179.483 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.82 ' O ' HG23 ' A' ' 21' ' ' VAL . 1.4 mp -58.62 -47.44 88.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 178.965 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 4.6 mmmt -63.13 -33.12 74.77 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.936 178.59 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.611 ' HB3' HD13 ' A' ' 50' ' ' LEU . 0.2 OUTLIER -57.77 -52.49 65.25 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.873 179.618 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.956 HD22 HG13 ' A' ' 30' ' ' ILE . 0.2 OUTLIER -76.06 -30.63 58.44 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.703 -0.399 . . . . 0.0 110.37 179.77 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.82 HG23 ' O ' ' A' ' 17' ' ' ILE . 53.1 t -62.76 -31.28 51.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 178.733 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -86.91 -39.89 15.34 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.878 178.975 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.804 ' CB ' HD11 ' A' ' 25' ' ' ILE . . . -73.91 -15.05 61.15 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.795 179.033 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.424 ' C ' HG13 ' A' ' 25' ' ' ILE . . . 43.48 77.69 0.08 OUTLIER Glycine 0 C--N 1.333 0.396 0 CA-C-N 116.013 -0.539 . . . . 0.0 114.224 179.136 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.804 HD11 ' CB ' ' A' ' 23' ' ' ALA . 0.2 OUTLIER -141.83 -171.74 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.246 0 CA-C-O 120.734 0.302 . . . . 0.0 110.785 178.745 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.536 ' H ' HG22 ' A' ' 25' ' ' ILE . . . -44.57 97.64 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.676 -179.477 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.489 ' O ' ' N ' ' A' ' 30' ' ' ILE . 10.5 pt-20 -45.85 -25.23 0.49 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.16 179.187 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -41.29 -47.61 3.47 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 121.45 0.643 . . . . 0.0 110.8 179.456 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.594 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 63.3 m-85 -59.3 -32.39 70.01 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.336 179.909 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.956 HG13 HD22 ' A' ' 20' ' ' LEU . 25.8 mt -62.21 -26.64 40.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.464 177.969 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 6.3 tttm -74.29 -36.1 63.75 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.61 179.662 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.594 ' HG ' ' O ' ' A' ' 29' ' ' TYR . 0.1 OUTLIER -61.51 -33.97 74.71 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 120.216 -0.594 . . . . 0.0 109.815 179.353 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.552 HG22 ' HA ' ' A' ' 42' ' ' VAL . 2.4 pt -91.91 -44.71 14.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.046 179.408 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.421 ' CB ' ' O ' ' A' ' 30' ' ' ILE . . . -61.1 -30.99 70.69 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.079 -179.651 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 23.6 t30 -81.57 -3.05 52.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.114 -179.858 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.78 ' CB ' HD21 ' A' ' 9' ' ' LEU . . . 49.92 -131.04 1.95 Allowed 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 116.549 -0.296 . . . . 0.0 111.242 179.465 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.416 ' HB2' ' O ' ' A' ' 36' ' ' ALA . 0.0 OUTLIER 76.16 -5.65 2.14 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 179.937 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.714 ' O ' HG23 ' A' ' 42' ' ' VAL . 0.6 OUTLIER -159.9 71.41 0.47 Allowed 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 110.287 -0.264 . . . . 0.0 110.287 179.684 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.542 HG13 ' N ' ' A' ' 40' ' ' GLU . 11.9 p -38.69 -50.63 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.906 -179.564 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.542 ' N ' HG13 ' A' ' 39' ' ' VAL . 2.1 mm-40 -61.05 -43.28 99.12 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 109.954 -0.388 . . . . 0.0 109.954 179.321 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.43 ' O ' ' HG ' ' A' ' 45' ' ' LEU . . . -66.9 -45.69 81.07 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.474 -0.869 . . . . 0.0 111.902 178.846 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 1.057 HG21 HD23 ' A' ' 9' ' ' LEU . 15.5 t -45.94 -39.36 3.17 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.111 0 CA-C-O 121.208 0.528 . . . . 0.0 110.352 179.141 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 45.9 t-105 -78.3 -32.06 49.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.586 179.004 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.408 ' HA ' ' OD2' ' A' ' 47' ' ' ASP . 1.3 m -77.74 -50.99 11.26 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.982 179.89 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.77 ' O ' HG22 ' A' ' 49' ' ' ILE . 0.9 OUTLIER -56.9 -34.51 67.98 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.314 179.543 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.464 ' CD ' ' HB2' ' A' ' 16' ' ' ALA . 11.3 ttpp -67.52 -58.42 4.74 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.633 179.877 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.408 ' OD2' ' HA ' ' A' ' 44' ' ' THR . 4.7 p30 -62.64 -27.43 69.21 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.362 -179.928 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -79.98 -51.29 9.25 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.74 179.64 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.77 HG22 ' O ' ' A' ' 45' ' ' LEU . 3.8 tp -57.49 -24.24 21.5 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 C-N-CA 120.741 -0.383 . . . . 0.0 110.917 179.997 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.611 HD13 ' HB3' ' A' ' 19' ' ' GLU . 2.3 tp -82.05 -35.15 29.06 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 178.89 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 10.8 m -65.22 -14.52 60.86 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 115.602 -0.726 . . . . 0.0 111.677 179.49 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.564 ' CG ' ' O ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER . . . . . 0 N--CA 1.463 0.176 0 CA-C-O 121.288 0.566 . . . . 0.0 111.551 -179.498 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.713 HD21 ' CB ' ' A' ' 36' ' ' ALA . 6.8 tt . . . . . 0 N--CA 1.451 -0.395 0 CA-C-O 120.877 0.37 . . . . 0.0 111.12 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.494 ' HA ' ' HD3' ' A' ' 13' ' ' LYS . 3.7 tttt -52.56 -31.54 36.46 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.628 179.904 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 13.7 tt0 -87.61 -37.73 16.55 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.565 179.849 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -55.86 -38.18 69.77 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.519 179.473 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.652 ' HB3' HG11 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -85.05 -35.31 21.96 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.6 179.692 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.776 ' O ' HG22 ' A' ' 17' ' ' ILE . 2.3 mm-40 -58.09 -50.04 74.85 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 178.707 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -65.13 -31.05 72.05 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 177.84 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.696 ' HB1' ' CD1' ' A' ' 33' ' ' ILE . . . -68.22 -43.45 77.94 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 115.215 -0.902 . . . . 0.0 111.663 -179.838 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.776 HG22 ' O ' ' A' ' 14' ' ' GLU . 8.4 tp -60.31 -35.5 62.78 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.265 0 C-N-CA 120.645 -0.422 . . . . 0.0 109.875 179.933 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.84 -32.21 65.31 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 177.887 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.696 ' CG ' HD13 ' A' ' 50' ' ' LEU . 0.3 OUTLIER -62.2 -52.7 62.73 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.176 -0.92 . . . . 0.0 111.753 -179.797 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.803 HD22 HG13 ' A' ' 30' ' ' ILE . 0.2 OUTLIER -76.82 -34.45 57.9 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.878 -0.329 . . . . 0.0 110.99 -179.612 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.611 HG23 ' O ' ' A' ' 17' ' ' ILE . 24.1 t -61.55 -31.13 49.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 120.885 0.374 . . . . 0.0 110.199 179.386 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -90.3 -36.61 14.59 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.31 179.306 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -78.16 -14.95 59.26 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.19 179.603 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.423 ' N ' ' O ' ' A' ' 20' ' ' LEU . . . 50.47 105.3 0.01 OUTLIER Glycine 0 CA--C 1.522 0.504 0 C-N-CA 121.252 -0.499 . . . . 0.0 113.291 179.491 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.538 HG21 ' CE1' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -174.76 -171.94 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.377 0 CA-C-N 117.185 0.492 . . . . 0.0 111.678 179.397 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -40.85 95.94 0.01 OUTLIER 'General case' 0 C--O 1.232 0.14 0 CA-C-N 115.911 -0.586 . . . . 0.0 112.213 -179.186 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.428 ' O ' ' N ' ' A' ' 30' ' ' ILE . 21.3 mt-10 -53.0 -25.63 12.71 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.544 179.122 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.7 tptm -46.06 -45.54 16.19 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.388 179.152 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.783 ' CG ' HD13 ' A' ' 49' ' ' ILE . 2.8 m-85 -61.37 -30.52 70.59 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.041 179.585 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.803 HG13 HD22 ' A' ' 20' ' ' LEU . 40.9 mt -62.24 -26.67 40.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 177.991 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.407 ' O ' ' HB3' ' A' ' 35' ' ' ASN . 2.8 tttp -74.12 -37.13 64.19 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.629 179.386 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.587 ' HG ' ' O ' ' A' ' 29' ' ' TYR . 0.1 OUTLIER -62.38 -32.74 73.59 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 120.191 -0.604 . . . . 0.0 109.962 179.527 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.696 ' CD1' ' HB1' ' A' ' 16' ' ' ALA . 4.0 pt -91.85 -46.3 14.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.105 179.517 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.405 ' CB ' ' O ' ' A' ' 30' ' ' ILE . . . -60.64 -30.53 69.93 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.906 -179.576 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ASN . . . . . 0.407 ' HB3' ' O ' ' A' ' 31' ' ' LYS . 34.1 t30 -83.48 -14.05 53.28 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.83 179.868 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.713 ' CB ' HD21 ' A' ' 9' ' ' LEU . . . 57.61 -138.74 0.88 Allowed 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.124 179.429 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.484 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 0.0 OUTLIER 89.07 -21.5 0.14 Allowed 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 122.582 0.353 . . . . 0.0 111.131 -179.54 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.727 ' O ' HG23 ' A' ' 42' ' ' VAL . 1.5 m -143.22 78.57 1.61 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.49 179.579 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.514 HG13 ' N ' ' A' ' 40' ' ' GLU . 7.8 p -40.51 -49.07 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.396 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.714 -179.642 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.514 ' N ' HG13 ' A' ' 39' ' ' VAL . 2.5 mt-10 -60.68 -43.22 97.97 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 179.421 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.421 ' O ' ' HG ' ' A' ' 45' ' ' LEU . . . -67.5 -47.88 60.21 Favored Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.55 -0.833 . . . . 0.0 111.935 179.073 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.727 HG23 ' O ' ' A' ' 38' ' ' THR . 8.8 t -43.58 -41.47 1.47 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.226 0 CA-C-O 121.188 0.518 . . . . 0.0 110.366 179.213 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 2.4 t-105 -78.38 -32.07 48.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.178 179.391 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.8 m -79.28 -48.85 13.41 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 120.782 0.325 . . . . 0.0 110.993 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.69 ' O ' HG22 ' A' ' 49' ' ' ILE . 1.8 mt -56.92 -36.87 70.71 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.056 179.569 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.572 ' HD3' ' HB2' ' A' ' 16' ' ' ALA . 7.4 ttpt -66.65 -60.2 2.92 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.486 179.309 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -57.71 -33.23 68.2 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.574 -179.916 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -76.35 -52.71 9.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.999 179.866 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.783 HD13 ' CG ' ' A' ' 29' ' ' TYR . 9.4 tp -59.43 -24.32 27.86 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.214 -179.83 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.696 HD13 ' CG ' ' A' ' 19' ' ' GLU . 3.2 tp -79.37 -34.34 42.09 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 178.741 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 23.0 m -59.04 -35.71 73.77 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.88 179.376 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.79 ' CG ' ' O ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.54 0.568 0 CA-C-O 121.447 0.642 . . . . 0.0 110.38 179.886 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 1.05 HD23 HG21 ' A' ' 42' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.98 0.419 . . . . 0.0 110.518 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.685 ' N ' HD13 ' A' ' 9' ' ' LEU . 35.7 mttt -59.38 -33.72 71.54 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.832 179.868 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.43 ' O ' ' HG2' ' A' ' 14' ' ' GLU . 2.3 mp0 -88.15 -36.55 16.78 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.056 -179.86 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.41 -37.23 72.42 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.84 0.352 . . . . 0.0 110.334 179.511 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.57 ' HB3' HG11 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -84.92 -37.38 20.61 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.773 179.678 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.477 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 4.1 pt-20 -56.56 -49.37 75.03 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 109.141 -0.688 . . . . 0.0 109.141 178.875 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.441 ' N ' ' CG ' ' A' ' 14' ' ' GLU . 0.8 OUTLIER -65.01 -31.54 72.83 Favored 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 108.774 -0.824 . . . . 0.0 108.774 177.738 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.703 ' HB1' ' CD1' ' A' ' 33' ' ' ILE . . . -65.09 -43.38 92.31 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.59 179.267 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.71 ' O ' HG23 ' A' ' 21' ' ' VAL . 37.1 mm -55.83 -48.26 78.5 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.207 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 178.771 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.6 pttt -60.98 -32.38 71.94 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.562 178.37 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.555 ' CG ' HD13 ' A' ' 50' ' ' LEU . 0.2 OUTLIER -65.76 -52.35 51.71 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.701 179.496 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.742 HD22 ' HB ' ' A' ' 30' ' ' ILE . 0.2 OUTLIER -73.55 -33.94 64.95 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.685 179.965 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.71 HG23 ' O ' ' A' ' 17' ' ' ILE . 54.4 t -64.64 -31.26 52.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 120.92 0.391 . . . . 0.0 110.169 179.219 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -88.77 -34.59 17.06 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.283 179.478 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.85 ' HB3' HD11 ' A' ' 25' ' ' ILE . . . -81.1 -15.22 56.55 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.313 179.505 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 41.73 82.67 0.02 OUTLIER Glycine 0 C--N 1.334 0.433 0 CA-C-N 116.216 -0.447 . . . . 0.0 113.846 179.362 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.85 HD11 ' HB3' ' A' ' 23' ' ' ALA . 0.1 OUTLIER -146.38 -163.3 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.219 0 CA-C-N 116.709 0.254 . . . . 0.0 110.909 179.397 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -43.89 95.3 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 120.782 0.325 . . . . 0.0 111.85 -179.447 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.626 ' O ' HG22 ' A' ' 30' ' ' ILE . 0.3 OUTLIER -52.18 -26.28 11.17 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.952 0.406 . . . . 0.0 110.561 179.415 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.5 tptm -46.69 -45.7 19.62 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-O 121.277 0.561 . . . . 0.0 110.319 179.135 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.788 ' CG ' HD13 ' A' ' 49' ' ' ILE . 3.6 m-85 -62.72 -31.01 71.85 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.878 179.558 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.742 ' HB ' HD22 ' A' ' 20' ' ' LEU . 1.6 tt -61.56 -26.51 39.8 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.627 178.322 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.03 -37.45 58.35 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.735 179.634 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.591 ' HG ' ' HA ' ' A' ' 29' ' ' TYR . 0.1 OUTLIER -60.52 -32.76 71.78 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 120.123 -0.631 . . . . 0.0 109.966 179.415 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.703 ' CD1' ' HB1' ' A' ' 16' ' ' ALA . 3.7 pt -91.76 -47.22 14.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.923 179.442 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.41 ' HB2' HD11 ' A' ' 17' ' ' ILE . . . -59.05 -29.23 67.15 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.999 -179.558 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 -85.72 -11.35 53.88 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.26 -179.763 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.632 ' CB ' HD21 ' A' ' 9' ' ' LEU . . . 56.88 -141.2 0.81 Allowed 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 116.774 -0.194 . . . . 0.0 111.065 179.615 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.484 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 0.0 OUTLIER 89.45 -21.33 0.14 Allowed 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 122.629 0.372 . . . . 0.0 111.34 179.978 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.892 ' O ' HG23 ' A' ' 42' ' ' VAL . 9.9 m -144.05 77.72 1.56 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.676 0.274 . . . . 0.0 110.55 179.791 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.529 HG13 ' N ' ' A' ' 40' ' ' GLU . 14.5 p -38.85 -48.44 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.405 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.703 -179.878 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.529 ' N ' HG13 ' A' ' 39' ' ' VAL . 1.8 tt0 -61.39 -52.86 62.84 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.153 179.569 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.753 ' H ' HG22 ' A' ' 38' ' ' THR . . . -61.79 -38.47 96.01 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.323 -0.942 . . . . 0.0 112.158 179.188 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 1.05 HG21 HD23 ' A' ' 9' ' ' LEU . 22.8 t -49.24 -45.32 17.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.938 0.399 . . . . 0.0 110.503 179.372 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.486 ' CZ2' ' HA ' ' A' ' 40' ' ' GLU . 1.1 p90 -79.04 -25.66 43.18 Favored 'General case' 0 N--CA 1.457 -0.121 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.028 179.308 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.422 ' N ' ' CD1' ' A' ' 43' ' ' TRP . 1.3 m -79.3 -47.53 15.7 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-O 120.885 0.374 . . . . 0.0 110.862 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.69 ' O ' HG22 ' A' ' 49' ' ' ILE . 4.4 mm? -61.19 -33.54 73.62 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.01 179.527 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.566 ' HD3' ' HB2' ' A' ' 16' ' ' ALA . 17.5 ttpt -67.85 -59.6 3.17 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.395 179.422 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.52 -32.56 70.41 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.291 179.888 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -76.35 -51.95 10.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.97 179.84 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.788 HD13 ' CG ' ' A' ' 29' ' ' TYR . 8.6 tp -59.85 -23.86 27.79 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.243 0 C-N-CA 120.691 -0.403 . . . . 0.0 111.353 -179.804 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.555 HD13 ' CG ' ' A' ' 19' ' ' GLU . 3.2 tp -79.77 -34.62 39.63 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 178.802 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 9.3 m -67.21 -17.08 64.67 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.569 -0.741 . . . . 0.0 111.826 179.514 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.65 ' CE1' HG21 ' A' ' 25' ' ' ILE . 0.0 OUTLIER . . . . . 0 N--CA 1.462 0.162 0 CA-C-O 121.502 0.667 . . . . 0.0 111.074 179.964 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.735 HD21 ' HB2' ' A' ' 36' ' ' ALA . 7.4 tt . . . . . 0 N--CA 1.455 -0.195 0 CA-C-O 120.867 0.365 . . . . 0.0 111.275 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.489 ' HA ' ' HD3' ' A' ' 13' ' ' LYS . 0.8 OUTLIER -51.82 -32.6 32.31 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.745 179.962 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -89.89 -29.14 18.75 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.879 179.939 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.97 -37.44 87.41 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.106 179.347 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.645 ' HB3' HG11 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -85.27 -35.39 21.56 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.862 179.66 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.72 ' O ' HG22 ' A' ' 17' ' ' ILE . 0.1 OUTLIER -61.21 -47.34 86.54 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 179.218 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -65.76 -34.19 77.61 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 177.913 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.523 ' HB1' ' CD1' ' A' ' 33' ' ' ILE . . . -68.33 -36.83 79.85 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.5 179.39 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.72 HG22 ' O ' ' A' ' 14' ' ' GLU . 1.1 tp -58.19 -35.89 55.09 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.249 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 179.286 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 19.8 mttt -75.11 -33.07 61.56 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.654 178.347 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.618 ' HB3' HD13 ' A' ' 50' ' ' LEU . 0.4 OUTLIER -62.2 -52.32 64.26 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.659 179.407 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.79 HD22 ' HB ' ' A' ' 30' ' ' ILE . 0.3 OUTLIER -69.93 -34.79 73.93 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.685 179.946 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.712 HG23 ' O ' ' A' ' 17' ' ' ILE . 37.7 t -64.78 -31.29 53.18 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.229 0 CA-C-O 120.937 0.399 . . . . 0.0 109.933 179.091 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -84.21 -38.09 21.01 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.031 179.15 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.748 ' HB3' HD11 ' A' ' 25' ' ' ILE . . . -76.79 -15.3 59.78 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.141 179.333 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.401 ' C ' HG13 ' A' ' 25' ' ' ILE . . . 41.18 90.07 0.01 OUTLIER Glycine 0 C--N 1.335 0.495 0 CA-C-N 116.211 -0.449 . . . . 0.0 113.856 179.258 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.748 HD11 ' HB3' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -155.51 -164.71 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.271 0 CA-C-O 120.713 0.292 . . . . 0.0 110.922 179.179 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.559 ' HB3' ' CD2' ' A' ' 29' ' ' TYR . . . -44.75 95.76 0.01 OUTLIER 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.844 -179.586 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.651 ' O ' HG22 ' A' ' 30' ' ' ILE . 53.2 mt-10 -48.42 -26.96 2.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.674 179.432 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 12.2 tptm -44.96 -45.45 10.53 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.504 179.274 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.615 ' HA ' ' HG ' ' A' ' 32' ' ' LEU . 75.8 m-85 -61.05 -32.52 72.15 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.422 0.629 . . . . 0.0 110.128 179.614 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.79 ' HB ' HD22 ' A' ' 20' ' ' LEU . 2.2 tt -61.9 -26.38 39.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.705 178.484 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.9 tppp? -75.68 -35.6 60.31 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.576 179.472 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.893 ' HB2' HD23 ' A' ' 45' ' ' LEU . 0.2 OUTLIER -59.77 -35.18 74.1 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 120.361 -0.536 . . . . 0.0 109.749 179.316 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.523 ' CD1' ' HB1' ' A' ' 16' ' ' ALA . 2.9 pt -90.76 -46.33 14.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.945 179.402 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -60.51 -28.82 68.68 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.086 -179.704 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 -84.41 -12.93 53.52 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.406 -179.7 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.735 ' HB2' HD21 ' A' ' 9' ' ' LEU . . . 62.7 -136.17 0.44 Allowed 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 116.86 -0.155 . . . . 0.0 110.84 179.61 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.489 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 0.0 OUTLIER 87.64 -14.86 0.42 Allowed 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 179.808 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.654 ' O ' HG23 ' A' ' 42' ' ' VAL . 5.5 t -158.82 79.17 0.78 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.868 0.366 . . . . 0.0 110.635 179.388 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.697 ' CA ' HD12 ' A' ' 9' ' ' LEU . 10.2 p -38.65 -49.97 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.483 0 CA-C-N 115.894 -0.593 . . . . 0.0 111.753 -179.794 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.548 ' N ' HG13 ' A' ' 39' ' ' VAL . 2.8 mt-10 -60.19 -43.09 96.19 Favored 'General case' 0 CA--C 1.52 -0.194 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 179.365 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.407 ' N ' ' O ' ' A' ' 38' ' ' THR . . . -67.66 -46.7 66.54 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.448 -0.882 . . . . 0.0 111.921 178.752 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.654 HG23 ' O ' ' A' ' 38' ' ' THR . 12.2 t -43.97 -40.99 1.65 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.197 0 CA-C-O 121.062 0.458 . . . . 0.0 110.399 179.339 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 4.6 t-105 -78.64 -32.26 47.27 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.163 179.39 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.6 m -79.14 -45.12 20.63 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.887 0.375 . . . . 0.0 110.913 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.893 HD23 ' HB2' ' A' ' 32' ' ' LEU . 0.4 OUTLIER -60.06 -34.98 74.16 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.894 179.546 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.452 ' HA ' HG22 ' A' ' 49' ' ' ILE . 9.7 ttpt -68.05 -61.04 2.04 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.366 179.409 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -57.03 -32.71 66.45 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.365 179.801 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -76.46 -52.82 9.09 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.811 179.772 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.727 HG22 ' O ' ' A' ' 45' ' ' LEU . 6.2 tp -59.39 -23.86 26.45 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.32 0 C-N-CA 120.759 -0.376 . . . . 0.0 111.179 -179.895 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.618 HD13 ' HB3' ' A' ' 19' ' ' GLU . 5.4 tp -79.57 -32.54 42.04 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.19 0.519 . . . . 0.0 109.613 178.856 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 16.3 m -68.31 -20.69 64.76 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.602 -0.726 . . . . 0.0 112.049 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.614 ' CG ' ' O ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER . . . . . 0 N--CA 1.465 0.276 0 CA-C-O 121.635 0.731 . . . . 0.0 111.185 -179.74 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.951 ' CD1' HG21 ' A' ' 42' ' ' VAL . 1.3 tp . . . . . 0 N--CA 1.455 -0.185 0 CA-C-O 120.929 0.395 . . . . 0.0 110.815 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.441 ' HA ' ' HD3' ' A' ' 13' ' ' LYS . 0.7 OUTLIER -59.39 -34.61 72.65 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.864 -179.938 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -88.5 -30.91 19.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.782 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.05 -37.75 83.75 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.085 179.321 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.613 ' HB3' HG11 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -85.03 -37.03 20.85 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.752 179.626 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.47 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 0.3 OUTLIER -58.45 -47.28 84.53 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 179.229 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -66.39 -33.11 74.97 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 177.837 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.609 ' HB1' ' CD1' ' A' ' 33' ' ' ILE . . . -64.0 -36.93 85.59 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.394 179.268 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.768 ' O ' HG23 ' A' ' 21' ' ' VAL . 4.9 mm -60.94 -50.95 78.45 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.337 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 178.697 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.29 -32.2 66.39 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.355 -0.839 . . . . 0.0 109.851 178.498 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.602 ' CG ' HD13 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -61.88 -52.47 63.99 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.081 179.694 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.863 HD22 HG13 ' A' ' 30' ' ' ILE . 0.2 OUTLIER -79.39 -29.58 42.13 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.756 -179.984 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.768 HG23 ' O ' ' A' ' 17' ' ' ILE . 65.0 t -64.91 -32.43 58.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.274 179.571 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -90.0 -38.11 13.85 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.035 179.232 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -76.24 -14.72 60.12 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.023 179.283 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 48.25 97.67 0.01 OUTLIER Glycine 0 C--N 1.332 0.344 0 C-N-CA 121.143 -0.551 . . . . 0.0 113.002 179.58 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.658 HG21 ' CE1' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -160.11 -166.64 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.26 0 CA-C-N 116.899 0.35 . . . . 0.0 111.125 179.734 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -47.76 94.56 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.85 -179.549 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.414 ' O ' ' N ' ' A' ' 30' ' ' ILE . 4.2 mm-40 -51.24 -26.9 7.85 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.069 0.461 . . . . 0.0 110.48 179.267 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -46.8 -44.81 19.53 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.065 178.926 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.757 ' CG ' HD13 ' A' ' 49' ' ' ILE . 3.5 m-85 -60.76 -31.72 71.06 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.067 179.5 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.863 HG13 HD22 ' A' ' 20' ' ' LEU . 43.2 mt -61.57 -26.53 39.85 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 CA-C-N 115.967 -0.56 . . . . 0.0 109.507 178.02 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.3 tttp -74.45 -35.92 63.35 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.477 179.399 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.902 ' HB2' HD23 ' A' ' 45' ' ' LEU . 0.2 OUTLIER -61.36 -33.83 74.3 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 120.377 -0.529 . . . . 0.0 109.93 179.464 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.609 ' CD1' ' HB1' ' A' ' 16' ' ' ALA . 2.3 pt -91.83 -46.65 14.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.831 179.506 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.402 ' CB ' ' O ' ' A' ' 30' ' ' ILE . . . -58.85 -29.56 67.03 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.889 -179.659 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 24.0 t30 -85.13 -7.07 59.24 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.218 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.798 ' HB1' HD21 ' A' ' 9' ' ' LEU . . . 51.62 -138.74 1.04 Allowed 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 116.704 -0.225 . . . . 0.0 111.248 179.401 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.51 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 0.0 OUTLIER 93.1 -24.66 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 122.749 0.419 . . . . 0.0 111.072 -179.886 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.699 ' O ' HG23 ' A' ' 42' ' ' VAL . 1.9 p -145.88 81.14 1.6 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.576 179.794 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.518 HG13 ' N ' ' A' ' 40' ' ' GLU . 13.6 p -41.79 -47.59 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.36 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.691 -179.863 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.518 ' N ' HG13 ' A' ' 39' ' ' VAL . 1.8 mt-10 -60.56 -41.83 95.37 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 179.461 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -72.21 -42.22 51.09 Favored Glycine 0 C--O 1.223 -0.589 0 C-N-CA 120.332 -0.937 . . . . 0.0 112.229 178.968 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.951 HG21 ' CD1' ' A' ' 9' ' ' LEU . 25.3 t -45.78 -44.75 4.75 Favored 'Isoleucine or valine' 0 C--O 1.232 0.182 0 CA-C-N 116.978 0.389 . . . . 0.0 110.927 179.583 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.475 ' CD1' ' HA ' ' A' ' 40' ' ' GLU . 13.1 p-90 -79.23 -28.84 42.51 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.177 179.669 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.7 m -79.73 -36.73 36.93 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 120.487 -0.485 . . . . 0.0 110.948 179.856 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.902 HD23 ' HB2' ' A' ' 32' ' ' LEU . 1.0 OUTLIER -68.14 -32.52 72.85 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.147 -0.479 . . . . 0.0 109.79 179.375 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.512 ' HD3' ' HB2' ' A' ' 16' ' ' ALA . 8.2 ttpt -69.81 -61.53 1.74 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.273 179.263 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -57.3 -27.71 62.4 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.103 179.579 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -79.91 -53.58 6.63 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.733 179.715 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.757 HD13 ' CG ' ' A' ' 29' ' ' TYR . 6.3 tp -58.33 -24.45 24.72 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.129 0 C-N-CA 120.729 -0.388 . . . . 0.0 111.027 -179.954 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.602 HD13 ' CG ' ' A' ' 19' ' ' GLU . 1.0 OUTLIER -80.91 -34.66 33.28 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 178.812 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 8.5 m -65.75 -15.69 63.08 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.699 179.483 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.658 ' CE1' HG21 ' A' ' 25' ' ' ILE . 0.0 OUTLIER . . . . . 0 CA--C 1.534 0.346 0 CA-C-O 121.604 0.716 . . . . 0.0 111.241 -179.651 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.969 ' CD1' HG21 ' A' ' 42' ' ' VAL . 4.1 tp . . . . . 0 C--O 1.232 0.145 0 CA-C-O 120.923 0.392 . . . . 0.0 111.296 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.414 ' HA ' ' HD3' ' A' ' 13' ' ' LYS . 3.2 mtpt -57.46 -36.76 71.85 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.298 -179.636 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -85.12 -39.14 18.25 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.073 -179.798 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.74 -38.04 66.66 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.622 179.684 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.747 ' HB3' HG11 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -85.03 -35.66 21.76 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.756 179.608 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.459 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 3.1 mm-40 -60.05 -50.52 73.4 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 179.075 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 68.8 tt0 -64.83 -31.81 73.22 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 178.038 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.577 ' CB ' HD12 ' A' ' 33' ' ' ILE . . . -65.0 -37.78 88.78 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.175 179.194 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.802 ' O ' HG23 ' A' ' 21' ' ' VAL . 20.6 mm -58.03 -46.31 87.98 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.169 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 178.398 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.69 -32.22 73.26 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.272 -0.877 . . . . 0.0 109.47 178.237 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.519 ' CB ' HD13 ' A' ' 50' ' ' LEU . 0.4 OUTLIER -63.64 -52.42 60.87 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.565 179.268 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.803 HD22 ' HB ' ' A' ' 30' ' ' ILE . 0.3 OUTLIER -70.9 -33.98 71.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.66 179.88 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.802 HG23 ' O ' ' A' ' 17' ' ' ILE . 78.1 t -63.9 -31.17 52.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.908 0.385 . . . . 0.0 110.07 179.103 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -87.08 -37.89 17.0 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.244 179.371 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.515 ' HB3' HD11 ' A' ' 25' ' ' ILE . . . -77.57 -15.39 59.27 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.211 179.63 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 40.19 90.27 0.01 OUTLIER Glycine 0 C--N 1.335 0.482 0 CA-C-N 116.279 -0.419 . . . . 0.0 114.057 179.267 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.618 HD12 ' N ' ' A' ' 25' ' ' ILE . 0.2 OUTLIER -162.76 -167.71 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.227 0 CA-C-N 116.839 0.32 . . . . 0.0 111.138 179.06 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -33.66 95.89 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 112.398 0.518 . . . . 0.0 112.398 -179.169 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.457 ' O ' HG22 ' A' ' 30' ' ' ILE . 0.0 OUTLIER -56.21 -25.75 48.42 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.501 179.443 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.12 -46.1 11.65 Favored 'General case' 0 C--O 1.239 0.507 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.899 179.402 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.634 ' HA ' ' HG ' ' A' ' 32' ' ' LEU . 3.3 m-85 -64.37 -30.36 71.4 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.242 0.544 . . . . 0.0 110.242 179.848 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.803 ' HB ' HD22 ' A' ' 20' ' ' LEU . 0.9 OUTLIER -62.0 -26.39 39.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.415 178.175 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.7 ttmm -75.62 -37.83 59.43 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.55 179.484 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.634 ' HG ' ' HA ' ' A' ' 29' ' ' TYR . 0.1 OUTLIER -59.24 -33.74 71.38 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 120.102 -0.639 . . . . 0.0 109.783 179.43 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.63 HG22 ' HA ' ' A' ' 42' ' ' VAL . 4.9 pt -90.87 -48.33 14.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.807 179.272 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -56.2 -28.89 59.92 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.886 -179.864 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -88.62 -15.95 33.7 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.946 179.755 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.781 ' HB1' HD21 ' A' ' 9' ' ' LEU . . . 61.73 -137.7 0.51 Allowed 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.011 179.458 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.468 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 12.1 mttt 90.33 -22.86 0.1 Allowed 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 122.875 0.47 . . . . 0.0 111.23 -179.789 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.736 ' O ' HG23 ' A' ' 42' ' ' VAL . 0.7 OUTLIER -143.58 79.43 1.63 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.584 179.748 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.51 HG13 ' N ' ' A' ' 40' ' ' GLU . 13.5 p -40.15 -47.72 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.595 -179.93 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.51 ' N ' HG13 ' A' ' 39' ' ' VAL . 1.9 mt-10 -62.8 -43.95 97.45 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 179.427 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.471 ' O ' ' N ' ' A' ' 45' ' ' LEU . . . -66.49 -46.7 75.16 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.482 -0.866 . . . . 0.0 111.759 178.836 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.969 HG21 ' CD1' ' A' ' 9' ' ' LEU . 17.0 t -44.83 -41.48 2.23 Favored 'Isoleucine or valine' 0 C--O 1.234 0.248 0 CA-C-O 121.215 0.531 . . . . 0.0 110.27 179.109 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 31.7 t-105 -76.62 -31.51 57.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.957 179.098 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 m -80.53 -53.1 6.88 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.765 0.316 . . . . 0.0 110.986 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.708 ' O ' HG22 ' A' ' 49' ' ' ILE . 3.7 mm? -52.86 -35.73 57.95 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.035 0.445 . . . . 0.0 109.93 179.468 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.532 ' HG3' ' HA ' ' A' ' 16' ' ' ALA . 1.2 ttmt -68.05 -59.54 3.17 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.114 179.241 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -57.71 -31.47 66.43 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.234 179.768 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -77.16 -52.59 9.0 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.891 179.795 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.708 HG22 ' O ' ' A' ' 45' ' ' LEU . 7.1 tp -60.78 -23.88 30.57 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-O 120.792 0.329 . . . . 0.0 111.144 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.519 HD13 ' CB ' ' A' ' 19' ' ' GLU . 5.4 tp -79.33 -32.95 43.5 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 178.675 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 31.6 m -61.99 -36.63 82.06 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.2 179.519 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.782 ' CG ' ' O ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.539 0.524 0 CA-C-O 121.556 0.693 . . . . 0.0 110.635 -179.882 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 1.069 HD23 HG21 ' A' ' 42' ' ' VAL . 0.0 OUTLIER . . . . . 0 CA--C 1.53 0.183 0 CA-C-O 120.628 0.251 . . . . 0.0 111.143 . . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.896 ' N ' HD13 ' A' ' 9' ' ' LEU . 0.0 OUTLIER -51.96 -37.25 52.21 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.933 0.397 . . . . 0.0 111.234 -179.478 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.08 -30.31 19.99 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.142 -179.794 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.19 -37.1 85.9 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.261 179.579 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.494 ' HG2' ' N ' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -85.22 -37.69 19.81 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.948 179.701 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.494 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -56.46 -45.77 80.68 Favored 'General case' 0 C--O 1.233 0.234 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 179.068 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -68.27 -33.53 74.53 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.382 -0.826 . . . . 0.0 108.876 177.859 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.6 ' HB1' ' CD1' ' A' ' 33' ' ' ILE . . . -66.36 -37.41 85.24 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.317 179.54 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.773 ' O ' HG23 ' A' ' 21' ' ' VAL . 32.0 mm -58.81 -48.47 86.06 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.171 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 178.751 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.66 -32.86 73.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.691 178.5 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.602 ' CG ' HD13 ' A' ' 50' ' ' LEU . 0.3 OUTLIER -61.51 -52.41 64.61 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.549 -0.75 . . . . 0.0 111.06 179.861 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.575 HD22 ' HB ' ' A' ' 30' ' ' ILE . 0.2 OUTLIER -76.26 -34.91 59.15 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.951 -179.659 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.773 HG23 ' O ' ' A' ' 17' ' ' ILE . 71.3 t -63.42 -31.12 51.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 120.941 0.4 . . . . 0.0 110.374 179.528 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -91.49 -34.38 14.82 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.427 179.6 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -79.96 -15.17 57.82 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.323 179.791 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.791 ' O ' HG23 ' A' ' 25' ' ' ILE . . . 46.42 102.49 0.01 OUTLIER Glycine 0 CA--C 1.523 0.59 0 C-N-CA 121.315 -0.469 . . . . 0.0 113.334 179.476 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.802 HD12 ' CE1' ' A' ' 52' ' ' PHE . 1.1 pt -172.99 -173.4 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.21 0 CA-C-N 117.003 0.401 . . . . 0.0 111.326 179.501 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -36.84 95.14 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 -179.242 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.612 ' O ' HG22 ' A' ' 30' ' ' ILE . 1.6 pt-20 -54.14 -25.48 22.55 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.732 179.47 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -44.52 -47.49 10.14 Favored 'General case' 0 C--O 1.239 0.522 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.593 179.303 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.632 ' HA ' ' HG ' ' A' ' 32' ' ' LEU . 2.1 m-85 -63.81 -30.46 71.55 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.237 0.541 . . . . 0.0 110.06 179.655 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.612 HG22 ' O ' ' A' ' 27' ' ' GLU . 1.4 tt -60.81 -26.42 38.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.397 177.953 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.1 tptm -76.07 -37.55 58.11 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.593 179.515 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.725 ' HB2' HD13 ' A' ' 45' ' ' LEU . 0.1 OUTLIER -60.48 -32.42 71.41 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 119.885 -0.726 . . . . 0.0 109.856 179.349 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.6 ' CD1' ' HB1' ' A' ' 16' ' ' ALA . 4.6 pt -91.86 -48.34 13.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.851 179.456 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.652 ' HB2' HD11 ' A' ' 17' ' ' ILE . . . -58.54 -29.35 66.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.907 -179.687 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 7.8 t-20 -85.19 -17.96 35.55 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.936 179.768 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.533 ' CB ' HD21 ' A' ' 9' ' ' LEU . . . 61.28 -143.32 0.47 Allowed 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 116.626 -0.261 . . . . 0.0 110.923 179.612 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.497 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 0.0 OUTLIER 90.18 -21.79 0.12 Allowed 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 122.633 0.373 . . . . 0.0 111.406 -179.973 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.869 ' O ' HG23 ' A' ' 42' ' ' VAL . 0.6 OUTLIER -141.39 77.02 1.57 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.683 0.277 . . . . 0.0 110.639 179.878 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.507 HG13 ' N ' ' A' ' 40' ' ' GLU . 12.3 p -39.38 -47.04 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.63 -179.851 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.507 ' N ' HG13 ' A' ' 39' ' ' VAL . 0.4 OUTLIER -61.16 -52.69 63.76 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 179.563 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.454 ' O ' ' HG ' ' A' ' 45' ' ' LEU . . . -63.35 -37.55 95.02 Favored Glycine 0 C--O 1.226 -0.372 0 C-N-CA 120.246 -0.978 . . . . 0.0 112.186 179.234 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 1.069 HG21 HD23 ' A' ' 9' ' ' LEU . 29.1 t -49.9 -44.53 21.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 121.067 0.46 . . . . 0.0 110.387 179.416 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.499 ' CZ2' ' HA ' ' A' ' 40' ' ' GLU . 1.1 p90 -81.49 -24.54 36.66 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.283 179.234 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.8 m -79.98 -48.04 14.0 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-O 120.874 0.369 . . . . 0.0 110.616 179.885 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.725 HD13 ' HB2' ' A' ' 32' ' ' LEU . 2.1 mt -62.02 -32.36 72.84 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.863 179.26 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.439 ' HG3' ' HA ' ' A' ' 16' ' ' ALA . 4.0 tttm -67.67 -60.02 2.87 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.468 179.421 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -60.58 -30.23 69.68 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.301 179.748 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 -77.22 -52.29 9.48 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.974 179.802 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.694 HG22 ' O ' ' A' ' 45' ' ' LEU . 7.2 tp -60.25 -24.03 29.47 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.07 -179.943 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.602 HD13 ' CG ' ' A' ' 19' ' ' GLU . 3.3 tp -79.38 -32.84 43.16 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 178.469 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 50.9 m -59.66 -37.46 78.81 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.915 179.205 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.802 ' CE1' HD12 ' A' ' 25' ' ' ILE . 0.0 OUTLIER . . . . . 0 CA--C 1.539 0.549 0 CA-C-O 121.58 0.705 . . . . 0.0 110.536 179.813 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.727 HD21 ' HB2' ' A' ' 36' ' ' ALA . 9.2 tt . . . . . 0 N--CA 1.453 -0.29 0 CA-C-O 121.017 0.436 . . . . 0.0 110.721 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.465 ' HA ' ' HD3' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -52.21 -34.0 43.62 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.738 -0.664 . . . . 0.0 110.825 179.842 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.401 ' O ' ' HG3' ' A' ' 14' ' ' GLU . 0.8 OUTLIER -89.3 -29.67 19.0 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.775 179.802 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.4 -38.07 88.22 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.057 179.239 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.631 ' HB3' HG11 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -85.41 -35.45 21.3 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.037 179.704 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.544 ' O ' HG22 ' A' ' 17' ' ' ILE . 0.3 OUTLIER -59.9 -42.33 93.61 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 179.128 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -72.18 -30.93 65.45 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 177.833 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.649 ' CB ' HD12 ' A' ' 33' ' ' ILE . . . -68.67 -47.2 67.12 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.071 -0.968 . . . . 0.0 111.149 179.661 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.709 ' O ' HG23 ' A' ' 21' ' ' VAL . 0.5 OUTLIER -57.2 -39.24 65.95 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.235 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 179.145 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.09 -32.47 72.81 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 177.384 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.562 ' CG ' HD13 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -66.11 -49.59 66.99 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.478 179.152 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.796 HD22 ' HB ' ' A' ' 30' ' ' ILE . 0.2 OUTLIER -74.47 -35.75 63.28 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.948 -179.758 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.709 HG23 ' O ' ' A' ' 17' ' ' ILE . 44.0 t -63.4 -31.22 52.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 120.847 0.356 . . . . 0.0 110.21 179.461 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -89.51 -34.91 16.23 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.334 179.589 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.411 ' HB3' HD11 ' A' ' 25' ' ' ILE . . . -79.7 -14.97 58.37 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.355 179.779 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.654 ' O ' HG23 ' A' ' 25' ' ' ILE . . . 46.33 97.39 0.01 OUTLIER Glycine 0 CA--C 1.522 0.506 0 C-N-CA 121.051 -0.595 . . . . 0.0 113.287 179.603 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.721 ' N ' HD13 ' A' ' 25' ' ' ILE . 0.1 OUTLIER -162.09 -176.62 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.461 0.122 0 CA-C-N 116.884 0.342 . . . . 0.0 111.479 179.986 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -45.69 96.38 0.01 OUTLIER 'General case' 0 CA--C 1.518 -0.267 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.596 -179.452 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.539 ' O ' HG22 ' A' ' 30' ' ' ILE . 19.5 mm-40 -45.62 -25.11 0.42 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.194 178.681 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.402 ' CD ' HD21 ' A' ' 32' ' ' LEU . 0.1 OUTLIER -39.53 -50.59 2.19 Favored 'General case' 0 C--O 1.239 0.519 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.917 178.754 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.665 ' CG ' HD13 ' A' ' 49' ' ' ILE . 2.8 m-85 -65.47 -32.83 74.65 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.972 179.665 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.796 ' HB ' HD22 ' A' ' 20' ' ' LEU . 1.0 OUTLIER -59.76 -26.28 34.73 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.391 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.556 178.091 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.7 tttm -75.94 -37.81 58.28 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.455 179.494 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.636 ' HG ' ' HA ' ' A' ' 29' ' ' TYR . 0.1 OUTLIER -59.57 -33.03 70.92 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 120.18 -0.608 . . . . 0.0 109.766 179.308 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.744 HG22 ' HA ' ' A' ' 42' ' ' VAL . 3.8 pt -91.8 -45.9 14.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.967 179.573 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -58.48 -28.8 65.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.678 -179.866 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -88.62 -12.53 42.31 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.123 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.727 ' HB2' HD21 ' A' ' 9' ' ' LEU . . . 61.45 -140.02 0.5 Allowed 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 116.734 -0.212 . . . . 0.0 110.996 179.391 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.547 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 0.0 OUTLIER 96.33 -27.41 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 122.783 0.433 . . . . 0.0 110.758 -179.786 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.701 ' O ' HG23 ' A' ' 42' ' ' VAL . 0.6 OUTLIER -144.03 83.37 1.74 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.598 179.73 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.699 ' CA ' HD12 ' A' ' 9' ' ' LEU . 8.8 p -40.77 -48.18 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.464 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.475 -179.879 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.518 ' N ' HG13 ' A' ' 39' ' ' VAL . 0.0 OUTLIER -61.86 -43.0 99.73 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.846 -0.427 . . . . 0.0 109.846 179.304 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.475 ' O ' ' N ' ' A' ' 45' ' ' LEU . . . -66.58 -46.51 75.99 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.522 -0.847 . . . . 0.0 111.762 178.879 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.744 ' HA ' HG22 ' A' ' 33' ' ' ILE . 10.6 t -45.29 -41.97 2.93 Favored 'Isoleucine or valine' 0 C--O 1.233 0.201 0 CA-C-O 121.287 0.565 . . . . 0.0 110.196 179.168 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 14.3 t90 -76.76 -30.28 56.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.987 179.255 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.5 m -82.43 -54.62 5.06 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.831 0.348 . . . . 0.0 111.161 -179.782 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.688 ' O ' HG22 ' A' ' 49' ' ' ILE . 3.9 mm? -52.93 -32.49 45.94 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 179.306 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.5 ' HG3' ' HA ' ' A' ' 16' ' ' ALA . 0.3 OUTLIER -70.02 -60.77 2.09 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.271 -0.877 . . . . 0.0 110.245 179.296 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -58.25 -31.91 67.86 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.196 179.656 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -75.49 -54.98 6.14 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.836 179.763 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.688 HG22 ' O ' ' A' ' 45' ' ' LEU . 7.7 tp -56.84 -23.88 18.71 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.188 0 C-N-CA 120.705 -0.398 . . . . 0.0 111.236 -179.85 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.562 HD13 ' CG ' ' A' ' 19' ' ' GLU . 4.2 tp -79.04 -34.91 43.42 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 178.931 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 17.4 m -66.06 -18.05 65.09 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.755 179.719 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.551 ' CG ' ' O ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.532 0.257 0 CA-C-O 121.467 0.651 . . . . 0.0 111.215 -179.732 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 43.9 m . . . . . 0 N--CA 1.489 1.508 0 CA-C-O 120.675 0.274 . . . . 0.0 111.382 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER 59.33 161.23 0.04 OUTLIER 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.867 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 7.3 t80 -107.76 26.51 10.22 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.566 -179.838 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.6 ' O ' HD12 ' A' ' 5' ' ' LEU . 0.2 OUTLIER -145.01 66.08 1.25 Allowed 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.869 179.82 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.6 HD12 ' O ' ' A' ' 4' ' ' LYS . 5.1 mp -146.5 62.79 1.21 Allowed 'General case' 0 C--O 1.235 0.325 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.813 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 3.4 pt -101.25 80.4 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.159 179.631 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 48.2 mt -131.85 137.83 48.23 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.796 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 6.1 p-10 -156.22 42.04 0.38 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.669 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.647 HD13 ' HB1' ' A' ' 36' ' ' ALA . 2.4 pp -67.67 -32.61 73.39 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.056 -179.854 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 17.4 tttm -54.36 -38.32 65.95 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.146 0.498 . . . . 0.0 110.354 179.75 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.403 ' HA ' ' HB2' ' A' ' 14' ' ' GLU . 0.1 OUTLIER -90.43 -32.91 16.21 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.388 179.393 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.539 ' HB3' ' HA ' ' A' ' 9' ' ' LEU . . . -60.06 -38.27 82.32 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.504 179.377 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.594 ' HB3' HG11 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -85.41 -36.85 20.41 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.445 179.352 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.466 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 6.1 mm-40 -56.48 -50.45 71.73 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 178.906 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -64.17 -34.24 77.62 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 177.901 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.593 ' HB1' ' CD1' ' A' ' 33' ' ' ILE . . . -65.19 -38.87 91.83 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.4 179.391 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.722 ' O ' HG23 ' A' ' 21' ' ' VAL . 26.1 mm -55.62 -50.03 69.85 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.168 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 178.767 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -60.62 -33.18 72.4 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.736 -0.666 . . . . 0.0 109.964 178.642 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.647 ' HB3' HD13 ' A' ' 50' ' ' LEU . 0.1 OUTLIER -61.74 -52.47 64.12 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.661 179.496 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.744 HD22 ' HB ' ' A' ' 30' ' ' ILE . 0.2 OUTLIER -76.08 -34.28 59.54 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.673 179.886 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.722 HG23 ' O ' ' A' ' 17' ' ' ILE . 64.1 t -64.43 -31.2 52.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-O 120.866 0.365 . . . . 0.0 110.086 179.38 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -88.24 -35.95 17.02 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.203 179.313 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.986 ' HB1' HG21 ' A' ' 53' ' ' THR . . . -78.84 -15.37 58.46 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.245 179.536 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 41.87 79.69 0.05 OUTLIER Glycine 0 CA--C 1.522 0.508 0 CA-C-N 116.307 -0.406 . . . . 0.0 113.799 179.451 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.845 HD11 ' HB3' ' A' ' 23' ' ' ALA . 0.1 OUTLIER -144.2 -162.63 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.233 0 CA-C-N 116.812 0.306 . . . . 0.0 110.999 179.346 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -43.25 95.45 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.185 0 CA-C-O 120.863 0.364 . . . . 0.0 111.801 -179.497 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.635 ' O ' HG22 ' A' ' 30' ' ' ILE . 0.4 OUTLIER -52.87 -26.03 13.48 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.576 179.504 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.96 -45.92 15.95 Favored 'General case' 0 C--O 1.237 0.445 0 CA-C-O 121.344 0.592 . . . . 0.0 110.294 179.223 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.826 ' CD1' HD13 ' A' ' 49' ' ' ILE . 4.0 m-85 -62.69 -31.82 72.79 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.074 179.657 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.744 ' HB ' HD22 ' A' ' 20' ' ' LEU . 1.8 tt -60.9 -26.56 39.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.0 -0.545 . . . . 0.0 109.659 178.445 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -76.62 -37.64 56.04 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.879 179.738 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.588 ' HG ' ' O ' ' A' ' 29' ' ' TYR . 0.0 OUTLIER -60.99 -32.29 71.87 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 120.034 -0.666 . . . . 0.0 109.941 179.51 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.593 ' CD1' ' HB1' ' A' ' 16' ' ' ALA . 3.9 pt -91.86 -45.99 14.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.017 179.365 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.38 -29.68 67.88 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.879 -179.732 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -87.29 -14.55 40.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.006 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.647 ' HB1' HD13 ' A' ' 9' ' ' LEU . . . 57.75 -131.71 1.36 Allowed 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.115 179.822 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.459 ' HB2' ' O ' ' A' ' 36' ' ' ALA . 0.0 OUTLIER 85.1 -19.24 0.34 Allowed 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 122.611 0.364 . . . . 0.0 111.131 -179.737 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.654 ' O ' HG23 ' A' ' 42' ' ' VAL . 0.2 OUTLIER -147.17 77.78 1.46 Allowed 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 179.583 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.521 HG13 ' N ' ' A' ' 40' ' ' GLU . 14.9 p -40.64 -49.19 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.953 -179.378 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.521 ' N ' HG13 ' A' ' 39' ' ' VAL . 0.4 OUTLIER -59.17 -42.68 91.38 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.778 -0.452 . . . . 0.0 109.778 179.373 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -69.15 -47.1 55.32 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.432 -0.889 . . . . 0.0 111.983 178.791 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.654 HG23 ' O ' ' A' ' 38' ' ' THR . 21.3 t -43.5 -41.59 1.43 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.249 0 CA-C-O 121.135 0.493 . . . . 0.0 110.538 179.322 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 39.2 t-105 -78.18 -32.16 49.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.784 -0.643 . . . . 0.0 110.988 179.512 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.8 m -78.47 -47.37 17.58 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.962 0.41 . . . . 0.0 110.992 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.71 ' O ' HG22 ' A' ' 49' ' ' ILE . 3.8 mm? -58.5 -35.1 71.7 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.228 179.525 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.451 ' HD3' ' HB2' ' A' ' 16' ' ' ALA . 1.7 ttpm? -68.12 -59.99 2.82 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.403 179.493 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.11 -31.58 69.06 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.361 179.797 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -77.42 -53.5 7.58 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 115.916 -0.583 . . . . 0.0 111.054 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.826 HD13 ' CD1' ' A' ' 29' ' ' TYR . 7.5 tp -57.01 -24.14 19.78 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.194 0 C-N-CA 120.702 -0.399 . . . . 0.0 111.203 -179.756 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.647 HD13 ' HB3' ' A' ' 19' ' ' GLU . 2.2 tp -80.13 -36.46 35.21 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 178.697 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 23.7 m -57.29 -24.64 56.24 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.622 178.831 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.577 ' CE1' HG21 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -86.96 15.78 5.6 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-O 120.811 0.338 . . . . 0.0 111.042 179.647 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.986 HG21 ' HB1' ' A' ' 23' ' ' ALA . 2.5 t -152.86 55.63 0.78 Allowed 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 121.054 0.454 . . . . 0.0 110.956 179.786 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 22.8 t -127.75 106.84 15.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.408 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 66.2 p -115.26 38.46 3.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.808 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 . . . . . 0 C--O 1.248 0.975 0 CA-C-O 118.128 -0.939 . . . . 0.0 110.781 -179.89 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 3.9 p . . . . . 0 N--CA 1.492 1.647 0 CA-C-O 121.13 0.49 . . . . 0.0 110.925 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.432 ' O ' ' CG ' ' A' ' 3' ' ' TYR . 0.9 OUTLIER -153.99 -50.49 0.09 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.919 -179.999 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 3' ' ' TYR . . . . . 0.432 ' CG ' ' O ' ' A' ' 2' ' ' THR . 30.6 p90 43.81 29.7 0.32 Allowed 'General case' 0 C--N 1.331 -0.23 0 O-C-N 123.586 0.554 . . . . 0.0 111.437 -179.532 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -171.57 -53.38 0.02 OUTLIER 'General case' 0 C--O 1.234 0.249 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.958 -179.886 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.448 HD23 HD11 ' A' ' 7' ' ' LEU . 0.2 OUTLIER 62.85 123.68 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.645 -179.932 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 13.9 mt -112.54 95.2 3.64 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.126 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.211 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.448 HD11 HD23 ' A' ' 5' ' ' LEU . 0.2 OUTLIER -130.53 166.23 21.02 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.48 179.772 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ASN . . . . . 0.683 ' OD1' HG21 ' A' ' 39' ' ' VAL . 10.2 p-10 -111.69 4.28 18.44 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.346 -179.825 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.653 HD13 ' HB1' ' A' ' 36' ' ' ALA . 2.6 pp -85.54 -35.16 21.29 Favored 'General case' 0 N--CA 1.455 -0.181 0 CA-C-O 120.887 0.375 . . . . 0.0 111.068 179.873 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.423 ' HA ' ' HD3' ' A' ' 13' ' ' LYS . 0.6 OUTLIER -52.22 -35.93 50.84 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.398 179.712 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 4.5 mt-30 -90.51 -32.52 16.3 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.467 179.442 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.429 ' HB3' ' HA ' ' A' ' 9' ' ' LEU . . . -60.81 -37.75 83.05 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.371 179.451 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.586 ' HB3' HG11 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -85.46 -37.47 19.71 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.419 179.466 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.476 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 5.8 mm-40 -57.77 -50.45 73.22 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 179.173 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -65.27 -32.46 74.13 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 177.964 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.547 ' HB1' ' CD1' ' A' ' 33' ' ' ILE . . . -66.97 -37.5 84.36 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.42 179.437 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.774 ' O ' HG23 ' A' ' 21' ' ' VAL . 21.0 mm -57.45 -48.21 83.3 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.14 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 178.713 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 18.4 mttt -63.59 -33.3 75.31 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.822 178.568 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.815 ' HB3' HD13 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -59.96 -52.24 66.24 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.692 179.53 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.575 HD22 ' HB ' ' A' ' 30' ' ' ILE . 0.3 OUTLIER -75.86 -32.41 59.73 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.747 -179.852 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.774 HG23 ' O ' ' A' ' 17' ' ' ILE . 53.9 t -64.3 -31.25 52.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.252 179.408 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -90.32 -38.3 13.46 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.436 179.591 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.454 ' O ' HG13 ' A' ' 25' ' ' ILE . . . -78.77 -15.55 58.28 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.438 179.797 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.721 ' O ' HG23 ' A' ' 25' ' ' ILE . . . 40.58 90.04 0.01 OUTLIER Glycine 0 C--N 1.335 0.515 0 CA-C-N 116.344 -0.389 . . . . 0.0 113.739 179.381 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.721 HG23 ' O ' ' A' ' 24' ' ' GLY . 0.4 OUTLIER -176.2 136.2 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.227 0 CA-C-O 121.072 0.463 . . . . 0.0 111.707 179.445 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . 38.11 89.97 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 115.616 -0.72 . . . . 0.0 112.558 179.696 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.634 ' O ' HG22 ' A' ' 30' ' ' ILE . 0.0 OUTLIER -62.82 -29.38 70.69 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.283 0.563 . . . . 0.0 109.637 178.557 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 2.6 tptt -46.08 -45.19 16.07 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.481 179.11 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.58 ' HA ' ' HG ' ' A' ' 32' ' ' LEU . 3.6 m-85 -64.0 -31.63 72.88 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.085 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.634 HG22 ' O ' ' A' ' 27' ' ' GLU . 1.6 tt -60.94 -26.19 38.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.732 178.322 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 12.7 tttt -77.89 -37.58 47.67 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.057 179.729 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.629 ' HB2' HD13 ' A' ' 45' ' ' LEU . 0.0 OUTLIER -60.69 -32.07 71.31 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 120.214 -0.594 . . . . 0.0 109.839 179.688 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.547 ' CD1' ' HB1' ' A' ' 16' ' ' ALA . 5.0 pt -91.7 -45.83 14.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.986 179.47 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.404 ' HB2' HD11 ' A' ' 17' ' ' ILE . . . -60.35 -29.09 68.67 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.003 -179.799 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 -86.47 -15.8 39.04 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.253 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.653 ' HB1' HD13 ' A' ' 9' ' ' LEU . . . 59.22 -139.4 0.72 Allowed 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 116.662 -0.245 . . . . 0.0 110.893 179.634 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.527 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 1.4 tptt 94.81 -26.71 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 122.688 0.395 . . . . 0.0 110.855 -179.691 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.667 ' O ' HG23 ' A' ' 42' ' ' VAL . 1.2 m -142.95 82.45 1.76 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.461 179.588 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.683 HG21 ' OD1' ' A' ' 8' ' ' ASN . 11.5 p -41.29 -47.66 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.568 -179.484 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.514 ' N ' HG13 ' A' ' 39' ' ' VAL . 1.8 mt-10 -60.39 -43.92 96.15 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.877 -0.416 . . . . 0.0 109.877 179.292 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.634 ' O ' ' HG ' ' A' ' 45' ' ' LEU . . . -67.91 -47.23 61.61 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 120.424 -0.893 . . . . 0.0 111.948 178.815 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.667 HG23 ' O ' ' A' ' 38' ' ' THR . 21.9 t -43.72 -41.52 1.56 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.259 0 CA-C-O 121.177 0.513 . . . . 0.0 110.584 179.195 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 37.0 t90 -78.59 -30.88 46.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.086 179.497 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.8 m -78.88 -44.93 21.74 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 120.722 0.296 . . . . 0.0 111.105 -179.887 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.703 ' O ' HG22 ' A' ' 49' ' ' ILE . 1.2 mt -61.86 -34.13 75.43 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.044 179.572 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.469 ' HG3' ' HA ' ' A' ' 16' ' ' ALA . 1.2 ttpt -68.38 -60.72 2.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.473 179.539 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -58.08 -30.51 66.28 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.247 179.713 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.61 -54.0 6.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.922 179.769 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.703 HG22 ' O ' ' A' ' 45' ' ' LEU . 5.3 tp -57.67 -24.06 21.68 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.141 0 C-N-CA 120.9 -0.32 . . . . 0.0 111.193 -179.892 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.815 HD13 ' HB3' ' A' ' 19' ' ' GLU . 4.3 tp -80.29 -35.86 35.21 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 178.998 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 17.3 m -66.26 -15.91 63.59 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.788 179.695 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.537 ' CG ' ' O ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -91.55 27.14 2.08 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-O 121.158 0.504 . . . . 0.0 111.509 -179.478 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.662 ' O ' HG22 ' A' ' 53' ' ' THR . 4.6 m -177.06 70.46 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.591 179.178 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 34.2 t -132.15 122.36 48.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.939 -179.492 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -127.43 106.39 9.16 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.821 179.786 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 . . . . . 0 C--O 1.246 0.882 0 CA-C-O 118.315 -0.85 . . . . 0.0 110.985 -179.984 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' THR . . . . . 0.5 ' O ' HG23 ' A' ' 2' ' ' THR . 12.0 t . . . . . 0 N--CA 1.48 1.037 0 CA-C-O 120.902 0.382 . . . . 0.0 111.405 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.5 HG23 ' O ' ' A' ' 1' ' ' THR . 5.7 p -159.07 -53.03 0.06 Allowed 'General case' 0 N--CA 1.451 -0.405 0 CA-C-O 120.905 0.384 . . . . 0.0 110.979 -179.929 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 60.92 19.46 9.79 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.909 0.385 . . . . 0.0 110.834 179.475 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.535 ' O ' HD12 ' A' ' 5' ' ' LEU . 0.0 OUTLIER -154.1 77.65 1.09 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.646 -0.252 . . . . 0.0 111.11 179.959 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.535 HD12 ' O ' ' A' ' 4' ' ' LYS . 0.4 OUTLIER -168.05 93.68 0.38 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.881 179.949 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 4.6 pt -129.42 -47.84 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.258 179.835 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 2.2 pp 169.64 163.87 0.06 Allowed 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 120.968 0.413 . . . . 0.0 110.935 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -150.81 35.78 0.62 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.026 179.556 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.795 HD13 ' HB1' ' A' ' 36' ' ' ALA . 2.6 pp -85.38 -32.45 22.39 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.073 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.431 ' HA ' ' HD3' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -50.85 -37.91 46.01 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.092 0.473 . . . . 0.0 110.627 -179.958 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.0 -32.77 16.62 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.536 179.787 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.425 ' HB3' ' HA ' ' A' ' 9' ' ' LEU . . . -60.91 -37.52 82.56 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.498 179.46 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.531 ' HB3' HG11 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -85.35 -37.54 19.79 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.477 179.371 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.479 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 2.8 mm-40 -56.86 -50.56 72.1 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 178.947 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -64.33 -34.69 78.74 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 177.977 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.519 ' HB1' ' CD1' ' A' ' 33' ' ' ILE . . . -64.46 -37.98 89.41 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.225 179.286 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.817 ' O ' HG23 ' A' ' 21' ' ' VAL . 23.6 mm -56.3 -47.53 81.0 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.158 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 178.689 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 18.2 mttp -62.86 -33.27 74.92 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.912 178.684 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.584 ' CG ' HD13 ' A' ' 50' ' ' LEU . 0.6 OUTLIER -61.42 -52.31 65.12 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.636 179.549 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.746 HD22 ' HB ' ' A' ' 30' ' ' ILE . 0.2 OUTLIER -72.51 -35.03 68.02 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.772 -179.963 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.817 HG23 ' O ' ' A' ' 17' ' ' ILE . 70.2 t -63.27 -31.17 51.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 120.809 0.338 . . . . 0.0 110.244 179.36 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -88.86 -36.09 16.18 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.463 179.508 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 1.07 ' HB1' HG21 ' A' ' 53' ' ' THR . . . -78.32 -15.42 58.74 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.341 179.715 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.402 ' C ' HG13 ' A' ' 25' ' ' ILE . . . 41.34 90.43 0.01 OUTLIER Glycine 0 CA--C 1.524 0.612 0 C-N-CA 121.507 -0.378 . . . . 0.0 113.792 179.44 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.745 HD11 ' HB3' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -156.32 -163.54 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 CA-C-N 116.649 0.224 . . . . 0.0 110.915 179.387 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -45.17 95.07 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 120.823 0.344 . . . . 0.0 111.699 -179.613 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.565 ' O ' HG22 ' A' ' 30' ' ' ILE . 7.8 mt-10 -52.24 -25.64 9.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.778 179.455 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -45.38 -46.81 13.42 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.593 179.402 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.642 ' HA ' ' HG ' ' A' ' 32' ' ' LEU . 1.1 m-85 -62.46 -30.42 71.23 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.283 0.563 . . . . 0.0 109.919 179.706 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.746 ' HB ' HD22 ' A' ' 20' ' ' LEU . 1.3 tt -60.81 -26.25 37.91 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.361 0 CA-C-N 115.778 -0.646 . . . . 0.0 109.361 177.941 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.42 -37.2 57.41 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.64 179.607 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.642 ' HG ' ' HA ' ' A' ' 29' ' ' TYR . 0.1 OUTLIER -59.82 -33.89 72.35 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 120.068 -0.653 . . . . 0.0 109.813 179.359 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.519 ' CD1' ' HB1' ' A' ' 16' ' ' ALA . 4.2 pt -90.78 -46.71 14.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.966 179.541 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.408 ' HB2' HD11 ' A' ' 17' ' ' ILE . . . -57.6 -28.64 63.81 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.774 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 16.6 t-20 -89.43 -15.72 32.54 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.944 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.795 ' HB1' HD13 ' A' ' 9' ' ' LEU . . . 59.08 -134.95 0.89 Allowed 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 116.67 -0.241 . . . . 0.0 110.964 179.633 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.492 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 5.6 ttmm 89.98 -22.61 0.11 Allowed 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 122.699 0.4 . . . . 0.0 111.145 -179.894 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.657 ' O ' HG23 ' A' ' 42' ' ' VAL . 1.2 m -145.67 79.0 1.56 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.396 179.675 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.513 HG13 ' N ' ' A' ' 40' ' ' GLU . 10.0 p -39.54 -48.54 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.426 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.641 -179.63 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.513 ' N ' HG13 ' A' ' 39' ' ' VAL . 3.1 mt-10 -58.08 -45.72 86.66 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 179.369 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -69.13 -43.59 71.09 Favored Glycine 0 N--CA 1.447 -0.594 0 C-N-CA 120.408 -0.901 . . . . 0.0 112.182 178.844 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.657 HG23 ' O ' ' A' ' 38' ' ' THR . 23.7 t -43.27 -46.69 1.49 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.175 0 CA-C-O 120.879 0.371 . . . . 0.0 110.834 179.696 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.491 ' CZ2' ' HA ' ' A' ' 40' ' ' GLU . 1.1 p90 -78.47 -27.52 46.33 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 120.612 -0.435 . . . . 0.0 110.979 179.277 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.434 ' N ' ' CD1' ' A' ' 43' ' ' TRP . 3.2 m -76.62 -49.28 16.64 Favored 'General case' 0 N--CA 1.463 0.184 0 C-N-CA 120.75 -0.38 . . . . 0.0 110.839 179.825 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.699 ' O ' HG22 ' A' ' 49' ' ' ILE . 3.6 mt -59.79 -33.07 71.23 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.224 179.585 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.415 ' HD2' ' HA ' ' A' ' 16' ' ' ALA . 6.7 ttpt -67.97 -59.0 3.6 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.359 179.562 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -60.66 -31.71 70.92 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.241 179.689 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -76.23 -52.64 9.61 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.931 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.699 HG22 ' O ' ' A' ' 45' ' ' LEU . 7.4 tp -58.43 -23.97 23.83 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.257 0 C-N-CA 120.784 -0.367 . . . . 0.0 111.16 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.584 HD13 ' CG ' ' A' ' 19' ' ' GLU . 1.5 tp -79.24 -34.94 42.3 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 178.549 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 34.3 m -61.26 -24.32 66.3 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.313 179.238 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.58 ' CE1' HG21 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -88.38 22.31 2.56 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 120.914 0.388 . . . . 0.0 111.179 -179.88 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 53' ' ' THR . . . . . 1.07 HG21 ' HB1' ' A' ' 23' ' ' ALA . 4.5 t -149.22 54.58 0.97 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.117 0.484 . . . . 0.0 111.246 179.662 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 41.9 t -147.85 -78.87 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.26 179.858 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -159.63 -166.79 1.84 Allowed 'General case' 0 N--CA 1.454 -0.265 0 CA-C-O 120.97 0.414 . . . . 0.0 110.942 179.63 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 12.9 tt0 . . . . . 0 C--O 1.248 0.984 0 CA-C-O 118.401 -0.809 . . . . 0.0 110.99 179.846 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 28.5 p . . . . . 0 N--CA 1.487 1.393 0 CA-C-O 120.924 0.392 . . . . 0.0 111.018 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 3.6 p -141.08 145.59 36.03 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.041 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' TYR . . . . . 0.699 ' HB2' HD13 ' A' ' 5' ' ' LEU . 13.0 p90 -112.87 -39.03 4.36 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.29 179.823 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 58.38 68.34 0.84 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.318 179.772 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.699 HD13 ' HB2' ' A' ' 3' ' ' TYR . 5.2 mp -135.14 178.0 7.37 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.182 0.515 . . . . 0.0 110.89 -179.873 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 5.2 mt -106.63 71.23 0.3 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.234 0 CA-C-O 121.101 0.477 . . . . 0.0 111.084 -179.901 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -109.23 147.27 32.84 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.623 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ASN . . . . . 0.401 ' H ' HG21 ' A' ' 39' ' ' VAL . 27.5 t-20 -162.35 51.12 0.2 Allowed 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.167 -179.851 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.524 ' HB3' HG23 ' A' ' 39' ' ' VAL . 3.0 pp -77.11 -34.28 56.81 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.909 0.385 . . . . 0.0 110.627 179.683 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.435 ' HA ' ' HD3' ' A' ' 13' ' ' LYS . 0.7 OUTLIER -53.61 -37.8 63.38 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.247 179.55 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.408 ' HA ' ' HB2' ' A' ' 14' ' ' GLU . 1.7 tt0 -89.88 -32.64 16.78 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.347 179.441 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.482 ' HB3' ' HA ' ' A' ' 9' ' ' LEU . . . -59.88 -38.28 81.76 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.321 179.371 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.579 ' HB3' HG11 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -85.46 -35.16 21.4 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.636 179.394 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.848 ' O ' HG22 ' A' ' 17' ' ' ILE . 2.1 mm-40 -60.43 -50.44 73.57 Favored 'General case' 0 C--O 1.234 0.263 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 179.049 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -64.41 -34.49 78.3 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 178.026 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.505 ' HB1' ' CD1' ' A' ' 33' ' ' ILE . . . -67.26 -36.34 81.4 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 115.177 -0.919 . . . . 0.0 110.436 179.587 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.848 HG22 ' O ' ' A' ' 14' ' ' GLU . 1.8 tp -59.9 -33.55 53.06 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.209 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 179.18 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 4.5 mttp -76.7 -33.21 58.23 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.583 178.348 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.582 ' CG ' HD13 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -59.05 -52.44 65.72 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.677 179.419 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.734 HD22 ' HB ' ' A' ' 30' ' ' ILE . 0.3 OUTLIER -71.41 -35.86 71.13 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.895 -179.842 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.744 HG23 ' O ' ' A' ' 17' ' ' ILE . 41.1 t -62.33 -31.28 51.18 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-O 120.982 0.42 . . . . 0.0 110.119 179.28 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -88.58 -35.27 16.99 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.96 179.14 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 1.03 ' HB1' HG21 ' A' ' 53' ' ' THR . . . -77.12 -15.19 59.64 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.17 179.45 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 39.66 85.93 0.01 OUTLIER Glycine 0 CA--C 1.521 0.449 0 CA-C-N 116.235 -0.439 . . . . 0.0 113.905 179.358 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.649 HD12 ' HG ' ' A' ' 20' ' ' LEU . 0.8 OUTLIER -163.41 -171.18 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 CA-C-N 116.716 0.258 . . . . 0.0 111.118 179.15 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.409 ' O ' HD21 ' A' ' 20' ' ' LEU . . . -28.78 95.73 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -179.096 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.616 ' O ' HG22 ' A' ' 30' ' ' ILE . 0.3 OUTLIER -58.96 -25.54 63.65 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.464 179.46 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -44.15 -46.6 8.84 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.681 179.473 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.934 ' CG ' HD13 ' A' ' 49' ' ' ILE . 3.5 m-85 -62.39 -31.24 71.88 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.291 0.567 . . . . 0.0 110.169 179.743 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.734 ' HB ' HD22 ' A' ' 20' ' ' LEU . 1.9 tt -60.79 -26.28 37.94 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.485 178.149 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 13.9 tttt -76.54 -37.13 57.14 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.704 179.632 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.618 ' HG ' ' HA ' ' A' ' 29' ' ' TYR . 0.1 OUTLIER -60.73 -32.67 71.93 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 120.095 -0.642 . . . . 0.0 109.834 179.494 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.505 ' CD1' ' HB1' ' A' ' 16' ' ' ALA . 5.1 pt -91.5 -45.62 14.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.966 179.444 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.56 -28.94 67.56 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.868 -179.823 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 20.6 t30 -87.97 -14.37 39.34 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.174 -179.917 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.533 ' O ' ' CB ' ' A' ' 37' ' ' LYS . . . 57.28 -139.42 0.88 Allowed 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 116.738 -0.21 . . . . 0.0 111.085 179.553 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.533 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 0.9 OUTLIER 95.44 -27.38 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 122.843 0.457 . . . . 0.0 110.734 -179.752 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.652 ' O ' HG23 ' A' ' 42' ' ' VAL . 1.0 OUTLIER -142.25 82.89 1.81 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.3 179.564 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.524 HG23 ' HB3' ' A' ' 9' ' ' LEU . 14.8 p -41.83 -47.21 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.307 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.658 -179.64 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.511 ' N ' HG13 ' A' ' 39' ' ' VAL . 0.0 OUTLIER -60.2 -43.29 96.04 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 179.254 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -68.87 -46.96 58.04 Favored Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.481 -0.866 . . . . 0.0 112.008 178.791 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.652 HG23 ' O ' ' A' ' 38' ' ' THR . 21.7 t -43.88 -41.88 1.7 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-O 121.135 0.493 . . . . 0.0 110.518 179.18 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 64.1 t-105 -77.71 -31.69 52.45 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.094 179.438 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.8 m -78.61 -44.6 23.56 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 120.748 0.309 . . . . 0.0 111.085 -179.831 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.689 ' O ' HG22 ' A' ' 49' ' ' ILE . 3.8 mm? -60.58 -35.07 75.19 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.083 179.479 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.447 ' CD ' ' HB2' ' A' ' 16' ' ' ALA . 0.8 OUTLIER -68.24 -60.38 2.51 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.459 179.554 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -59.47 -29.73 68.03 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.322 179.739 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -78.14 -54.24 6.47 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.974 179.851 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.934 HD13 ' CG ' ' A' ' 29' ' ' TYR . 8.6 tp -56.1 -24.32 17.48 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 C-N-CA 120.828 -0.349 . . . . 0.0 111.061 -179.735 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.854 ' O ' HG13 ' A' ' 54' ' ' VAL . 1.2 tp -81.07 -35.7 31.4 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 178.526 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.513 ' O ' HG22 ' A' ' 54' ' ' VAL . 7.5 m -55.58 -27.37 48.87 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.244 178.724 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.603 ' HD2' ' O ' ' A' ' 49' ' ' ILE . 0.0 OUTLIER -78.33 1.75 20.8 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-O 120.874 0.369 . . . . 0.0 110.27 178.836 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 53' ' ' THR . . . . . 1.03 HG21 ' HB1' ' A' ' 23' ' ' ALA . 2.1 t -145.39 50.7 1.21 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.253 179.243 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.854 HG13 ' O ' ' A' ' 50' ' ' LEU . 34.0 m -134.11 -174.26 1.15 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.274 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.016 -179.436 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.9 m 64.4 115.83 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.118 0 CA-C-O 121.134 0.492 . . . . 0.0 110.697 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.247 0.961 0 CA-C-O 118.158 -0.925 . . . . 0.0 110.994 179.763 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' THR . . . . . 0.409 ' O ' ' N ' ' A' ' 3' ' ' TYR . 24.9 p . . . . . 0 N--CA 1.493 1.677 0 CA-C-O 120.602 0.239 . . . . 0.0 110.827 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.8 p 51.7 -87.35 0.01 OUTLIER 'General case' 0 C--O 1.236 0.372 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.385 179.813 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' TYR . . . . . 0.409 ' N ' ' O ' ' A' ' 1' ' ' THR . 19.5 t80 56.45 34.29 24.01 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.723 0.297 . . . . 0.0 110.82 179.803 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.66 86.15 1.52 Allowed 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.086 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -136.91 124.8 22.65 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.915 179.879 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 2.6 pt -102.08 33.69 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.336 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -155.89 121.21 4.84 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.83 -179.86 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 -162.42 50.11 0.18 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.869 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.765 HD13 ' HB1' ' A' ' 36' ' ' ALA . 3.1 pp -83.89 -32.53 25.13 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.912 -179.923 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 7.7 tttm -52.03 -38.84 58.33 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.032 0.444 . . . . 0.0 110.514 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.28 -33.2 18.13 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.445 179.553 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.452 ' HB3' ' HA ' ' A' ' 9' ' ' LEU . . . -59.64 -37.54 78.94 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.584 179.465 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.578 ' HB3' HG11 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -85.42 -35.97 20.96 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.526 179.425 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.46 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 23.9 mt-10 -57.04 -50.41 72.84 Favored 'General case' 0 C--O 1.237 0.403 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 178.915 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -63.96 -33.89 76.75 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 177.666 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.581 ' HB1' ' CD1' ' A' ' 33' ' ' ILE . . . -64.55 -38.49 91.18 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.205 179.246 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.875 ' O ' HG23 ' A' ' 21' ' ' VAL . 26.7 mm -56.12 -52.49 50.01 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.13 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 178.823 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.38 -33.06 70.73 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.845 178.58 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.556 ' CG ' HD13 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -59.95 -52.24 66.23 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.382 179.324 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.776 HD22 ' HB ' ' A' ' 30' ' ' ILE . 0.3 OUTLIER -72.74 -32.31 65.58 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.418 179.748 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.875 HG23 ' O ' ' A' ' 17' ' ' ILE . 87.9 t -62.6 -32.11 54.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 120.904 0.383 . . . . 0.0 110.276 179.328 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.407 ' OD2' ' HA ' ' A' ' 19' ' ' GLU . 1.5 p30 -88.19 -40.12 13.95 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.28 179.412 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.32 -15.28 60.96 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.178 179.424 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.421 ' C ' HG13 ' A' ' 25' ' ' ILE . . . 37.57 89.55 0.01 OUTLIER Glycine 0 CA--C 1.522 0.525 0 CA-C-N 116.121 -0.491 . . . . 0.0 114.036 179.296 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.703 HD12 ' HG ' ' A' ' 20' ' ' LEU . 0.5 OUTLIER -159.08 -168.83 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.214 0 CA-C-N 116.653 0.227 . . . . 0.0 111.058 179.285 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -33.47 95.73 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -179.269 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.655 ' O ' HG22 ' A' ' 30' ' ' ILE . 1.3 mp0 -54.41 -25.68 26.16 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.562 179.562 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.4 tptt -44.57 -46.37 9.94 Favored 'General case' 0 C--O 1.238 0.489 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.608 179.519 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.579 ' HA ' ' HG ' ' A' ' 32' ' ' LEU . 3.3 m-85 -62.97 -31.66 72.82 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.189 0.518 . . . . 0.0 110.209 179.819 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.776 ' HB ' HD22 ' A' ' 20' ' ' LEU . 2.0 tt -60.61 -26.17 37.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.683 178.347 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 7.1 tptt -77.44 -37.67 51.13 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.884 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.579 ' HG ' ' HA ' ' A' ' 29' ' ' TYR . 0.0 OUTLIER -60.96 -31.88 71.43 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 120.044 -0.662 . . . . 0.0 110.027 179.583 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.581 ' CD1' ' HB1' ' A' ' 16' ' ' ALA . 3.2 pt -91.72 -46.05 14.4 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.938 179.371 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -58.75 -28.87 66.31 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.953 -179.888 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 16.6 t-20 -89.12 -13.54 38.27 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.058 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.765 ' HB1' HD13 ' A' ' 9' ' ' LEU . . . 58.14 -136.32 0.95 Allowed 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 116.69 -0.232 . . . . 0.0 111.054 179.643 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.529 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 24.2 tttt 94.8 -26.86 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 122.767 0.427 . . . . 0.0 110.718 -179.701 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.649 ' O ' HG23 ' A' ' 42' ' ' VAL . 0.2 OUTLIER -144.4 83.17 1.71 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.31 179.673 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.505 HG13 ' N ' ' A' ' 40' ' ' GLU . 12.9 p -41.34 -47.52 0.79 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.651 -179.598 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.505 ' N ' HG13 ' A' ' 39' ' ' VAL . 0.4 OUTLIER -60.6 -43.27 97.61 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 179.194 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.581 ' O ' ' HG ' ' A' ' 45' ' ' LEU . . . -67.75 -46.52 67.27 Favored Glycine 0 N--CA 1.448 -0.567 0 C-N-CA 120.526 -0.845 . . . . 0.0 111.884 178.774 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.649 HG23 ' O ' ' A' ' 38' ' ' THR . 20.7 t -45.19 -39.63 2.25 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 CA-C-O 121.171 0.51 . . . . 0.0 110.494 179.281 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 1.9 t90 -79.56 -30.41 41.67 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.87 179.336 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.7 m -78.93 -48.25 14.92 Favored 'General case' 0 C--N 1.334 -0.084 0 CA-C-O 120.892 0.377 . . . . 0.0 110.836 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.746 ' O ' HG22 ' A' ' 49' ' ' ILE . 1.5 mt -59.3 -34.7 72.62 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.145 179.564 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.484 ' HD3' ' HB2' ' A' ' 16' ' ' ALA . 3.5 ttpp -68.51 -59.02 3.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.416 179.495 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.02 -30.1 67.76 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.223 179.676 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -78.04 -54.32 6.41 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.847 179.713 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.746 HG22 ' O ' ' A' ' 45' ' ' LEU . 4.1 tp -56.6 -23.93 18.15 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.208 0 C-N-CA 120.858 -0.337 . . . . 0.0 110.923 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.556 HD13 ' CG ' ' A' ' 19' ' ' GLU . 3.4 tp -80.74 -33.52 35.06 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 178.525 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 38.1 m -60.13 -26.34 66.19 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.617 -0.72 . . . . 0.0 111.199 179.462 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.759 ' CG ' ' O ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -86.06 44.17 1.11 Allowed 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 121.466 0.651 . . . . 0.0 111.01 -179.803 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.745 ' O ' HG12 ' A' ' 54' ' ' VAL . 1.2 m 169.22 -64.5 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 115.914 -0.585 . . . . 0.0 109.693 179.614 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.745 HG12 ' O ' ' A' ' 53' ' ' THR . 9.9 p 53.24 160.79 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.455 -0.183 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.933 179.707 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.449 ' N ' HG22 ' A' ' 54' ' ' VAL . 35.3 p 51.57 -81.5 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.424 -179.912 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.51 ' N ' ' O ' ' A' ' 54' ' ' VAL . 6.2 mm-40 . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.252 -0.88 . . . . 0.0 110.82 -179.781 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 10.3 t . . . . . 0 N--CA 1.488 1.45 0 CA-C-O 120.844 0.354 . . . . 0.0 111.195 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -152.59 139.58 19.15 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.236 0.541 . . . . 0.0 110.775 -179.736 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' TYR . . . . . 0.421 ' HB3' HD12 ' A' ' 5' ' ' LEU . 12.1 t80 -80.28 -19.22 47.24 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.415 179.614 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 5.6 ttpt 68.68 60.93 0.36 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.057 0.456 . . . . 0.0 110.629 179.698 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.421 HD12 ' HB3' ' A' ' 3' ' ' TYR . 1.5 mt -102.88 78.44 1.67 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.67 -179.938 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 4.2 mt 66.11 119.37 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.756 179.556 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 2.4 mm? 63.45 116.92 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.942 179.673 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ASN . . . . . 0.461 ' H ' HG21 ' A' ' 39' ' ' VAL . 1.3 t-20 -169.09 57.94 0.05 OUTLIER 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.592 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.757 HD13 ' HB1' ' A' ' 36' ' ' ALA . 3.1 pp -77.13 -32.51 56.49 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.977 -179.847 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.43 ' HA ' ' HD3' ' A' ' 13' ' ' LYS . 12.4 tttp -50.66 -37.38 40.54 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.571 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -89.97 -29.26 18.58 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.703 179.705 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.99 -38.25 90.41 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.172 179.298 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.562 ' HB3' HG11 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -85.6 -35.26 21.13 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.06 179.725 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.74 ' O ' HG22 ' A' ' 17' ' ' ILE . 0.4 OUTLIER -59.15 -43.96 92.07 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.58 0.705 . . . . 0.0 109.238 179.035 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -70.75 -31.08 67.76 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.442 -0.799 . . . . 0.0 108.973 177.941 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.595 ' HB1' ' CD1' ' A' ' 33' ' ' ILE . . . -70.42 -41.82 72.42 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 115.217 -0.901 . . . . 0.0 111.307 -179.743 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.74 HG22 ' O ' ' A' ' 14' ' ' GLU . 0.8 OUTLIER -60.09 -35.51 61.91 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.285 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 179.305 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -70.48 -32.5 70.04 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 108.979 -0.749 . . . . 0.0 108.979 177.54 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.612 ' HG3' HD13 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -63.44 -52.53 61.08 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.16 -0.927 . . . . 0.0 111.266 179.801 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.454 ' HG ' HG13 ' A' ' 25' ' ' ILE . 0.2 OUTLIER -77.45 -35.18 54.16 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.192 -179.461 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.566 HG23 ' O ' ' A' ' 17' ' ' ILE . 37.1 t -65.22 -31.01 52.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 120.883 0.373 . . . . 0.0 110.298 179.57 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 23.2 m-20 -91.12 -33.18 15.56 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.7 179.747 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -83.8 -14.96 50.13 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.526 179.863 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.425 ' C ' ' CG1' ' A' ' 25' ' ' ILE . . . 55.18 112.46 0.01 OUTLIER Glycine 0 CA--C 1.523 0.586 0 C-N-CA 121.071 -0.585 . . . . 0.0 112.951 179.481 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.562 HG21 ' CE1' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -178.82 -173.69 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.357 0 CA-C-N 117.165 0.482 . . . . 0.0 111.407 179.478 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -43.77 94.56 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.133 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.832 -179.421 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.585 ' O ' HG22 ' A' ' 30' ' ' ILE . 3.0 mt-10 -50.86 -26.74 6.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.528 179.347 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -46.67 -46.33 19.9 Favored 'General case' 0 C--O 1.238 0.483 0 CA-C-O 121.325 0.584 . . . . 0.0 110.211 179.055 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.701 ' CG ' HD13 ' A' ' 49' ' ' ILE . 3.0 m-85 -62.08 -32.13 72.64 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 121.41 0.624 . . . . 0.0 109.767 179.413 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.585 HG22 ' O ' ' A' ' 27' ' ' GLU . 1.2 tt -60.59 -26.25 37.2 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.659 178.31 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.4 ttpt -76.2 -36.56 58.56 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.606 179.471 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.89 ' HB2' HD23 ' A' ' 45' ' ' LEU . 0.2 OUTLIER -59.73 -34.03 72.4 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 120.394 -0.523 . . . . 0.0 109.76 179.188 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.601 HG22 ' HA ' ' A' ' 42' ' ' VAL . 2.9 pt -91.82 -45.56 14.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.959 179.6 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.67 -29.41 68.04 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.771 -179.836 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 30.7 t30 -87.39 -12.68 45.55 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.031 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.757 ' HB1' HD13 ' A' ' 9' ' ' LEU . . . 59.28 -134.31 0.9 Allowed 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.062 179.675 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.52 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 1.0 OUTLIER 92.9 -40.59 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 122.79 0.436 . . . . 0.0 110.537 -179.686 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.612 ' O ' HG23 ' A' ' 42' ' ' VAL . 13.8 p -129.97 82.47 2.07 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.25 179.476 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.536 HG13 ' N ' ' A' ' 40' ' ' GLU . 12.6 p -41.69 -49.14 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.358 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.772 -179.63 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.536 ' N ' HG13 ' A' ' 39' ' ' VAL . 0.1 OUTLIER -58.34 -41.83 85.52 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 179.168 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -68.96 -47.67 53.03 Favored Glycine 0 N--CA 1.448 -0.554 0 C-N-CA 120.609 -0.805 . . . . 0.0 111.982 178.811 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.612 HG23 ' O ' ' A' ' 38' ' ' THR . 17.4 t -42.84 -40.78 1.04 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.192 0 CA-C-O 121.191 0.52 . . . . 0.0 110.493 179.23 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 68.0 t-105 -79.21 -32.89 44.12 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.199 179.342 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.6 m -79.79 -49.62 11.75 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-O 120.997 0.427 . . . . 0.0 111.021 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.89 HD23 ' HB2' ' A' ' 32' ' ' LEU . 0.4 OUTLIER -56.81 -34.97 68.21 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.033 179.428 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.447 ' HG3' ' HA ' ' A' ' 16' ' ' ALA . 3.5 tttm -68.54 -60.21 2.59 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.4 179.341 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -57.98 -32.27 67.73 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.415 179.714 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -76.18 -53.49 8.2 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.08 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.71 HG22 ' O ' ' A' ' 45' ' ' LEU . 7.3 tp -57.38 -24.28 21.24 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.171 0 C-N-CA 120.649 -0.42 . . . . 0.0 111.265 -179.777 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.612 HD13 ' HG3' ' A' ' 19' ' ' GLU . 2.2 tp -79.24 -35.84 40.91 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 178.794 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 44.1 m -59.31 -25.44 64.16 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.011 178.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.562 ' CE1' HG21 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -89.05 17.86 5.45 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-O 120.924 0.392 . . . . 0.0 111.042 -179.992 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.598 ' O ' HG23 ' A' ' 53' ' ' THR . 10.6 t -148.31 58.4 1.08 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.136 0.493 . . . . 0.0 111.357 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.537 HG13 ' OXT' ' A' ' 56' ' ' GLU . 9.9 p -151.81 142.73 15.86 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.314 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.315 179.504 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.36 -69.33 0.24 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.983 -179.765 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.537 ' OXT' HG13 ' A' ' 54' ' ' VAL . 8.4 mt-10 . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.453 -0.784 . . . . 0.0 111.445 179.594 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' THR . . . . . 0.467 HG22 ' H ' ' A' ' 2' ' ' THR . 1.3 m . . . . . 0 N--CA 1.489 1.51 0 CA-C-O 120.69 0.281 . . . . 0.0 111.274 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.597 HG21 HD21 ' A' ' 5' ' ' LEU . 1.6 p -122.86 -44.93 2.18 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.043 179.734 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 61.79 17.09 8.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.141 -179.923 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -171.25 93.83 0.17 Allowed 'General case' 0 CA--C 1.522 -0.101 0 CA-C-O 121.114 0.483 . . . . 0.0 110.76 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.597 HD21 HG21 ' A' ' 2' ' ' THR . 5.0 mt -130.91 -66.23 0.76 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.082 179.919 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 18.9 tt -178.18 158.57 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.208 179.735 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.716 HD12 HG11 ' A' ' 39' ' ' VAL . 6.0 mt -97.39 -82.91 0.4 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.75 -179.532 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 19.2 t30 -179.45 51.03 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.961 0.41 . . . . 0.0 111.041 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.77 HD13 ' HB1' ' A' ' 36' ' ' ALA . 3.4 pp -74.18 -32.48 63.1 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.027 179.912 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.47 -38.3 53.14 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.734 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.44 -29.12 20.43 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.783 179.691 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.67 -37.05 85.87 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.198 179.466 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.586 ' HB3' HG11 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -85.27 -37.81 19.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.75 179.54 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.48 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -56.97 -46.73 81.98 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 179.101 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.404 ' N ' ' HG3' ' A' ' 14' ' ' GLU . 6.8 tp10 -66.42 -36.06 81.86 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 177.952 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.532 ' HA ' ' HG3' ' A' ' 46' ' ' LYS . . . -64.22 -39.76 94.64 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 115.147 -0.933 . . . . 0.0 110.193 179.368 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.727 HD13 HG12 ' A' ' 30' ' ' ILE . 25.7 mm -54.39 -46.91 70.29 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.167 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 178.57 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 24.3 mmtm -62.01 -33.23 73.95 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.717 178.366 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.547 ' HG3' HD13 ' A' ' 50' ' ' LEU . 0.5 OUTLIER -62.04 -52.53 63.59 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.613 179.55 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.704 HD22 ' HB ' ' A' ' 30' ' ' ILE . 0.2 OUTLIER -76.86 -34.4 57.82 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.942 -179.818 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.708 HG23 ' O ' ' A' ' 17' ' ' ILE . 52.8 t -63.08 -31.24 51.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 120.866 0.365 . . . . 0.0 110.188 179.535 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -90.26 -35.37 15.34 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.6 179.513 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.415 ' O ' ' O ' ' A' ' 24' ' ' GLY . . . -79.02 -15.26 58.48 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.4 179.732 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.872 ' O ' HG23 ' A' ' 25' ' ' ILE . . . 44.37 105.9 0.01 OUTLIER Glycine 0 CA--C 1.526 0.758 0 N-CA-C 114.243 0.457 . . . . 0.0 114.243 179.009 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.872 HG23 ' O ' ' A' ' 24' ' ' GLY . 1.7 pp -176.41 -170.86 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 CA-C-N 116.823 0.312 . . . . 0.0 110.556 178.646 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -35.91 94.97 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.325 0 N-CA-C 112.225 0.454 . . . . 0.0 112.225 -179.387 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.618 ' O ' HG22 ' A' ' 30' ' ' ILE . 4.7 pt-20 -54.55 -25.38 25.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.67 179.572 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -43.08 -47.68 6.06 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.928 179.457 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.669 ' HA ' ' HG ' ' A' ' 32' ' ' LEU . 3.4 m-85 -63.12 -32.75 74.21 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.292 0.568 . . . . 0.0 110.092 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.727 HG12 HD13 ' A' ' 17' ' ' ILE . 1.4 tt -59.71 -26.27 34.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.67 178.295 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.5 tppp? -76.83 -37.06 56.36 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.637 179.583 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.896 ' HB2' HD23 ' A' ' 45' ' ' LEU . 0.2 OUTLIER -58.95 -34.06 71.32 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 120.299 -0.56 . . . . 0.0 109.802 179.379 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.607 HG22 ' HA ' ' A' ' 42' ' ' VAL . 3.0 pt -91.68 -45.88 14.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.882 179.378 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.513 ' HB2' HD11 ' A' ' 17' ' ' ILE . . . -57.99 -28.89 64.8 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.747 179.961 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 11.0 t-20 -88.05 -15.99 34.83 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.079 179.894 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.77 ' HB1' HD13 ' A' ' 9' ' ' LEU . . . 60.31 -137.84 0.65 Allowed 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.985 179.596 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.516 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 2.9 tppt? 93.69 -26.0 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 122.753 0.421 . . . . 0.0 110.87 -179.523 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.676 ' O ' HG23 ' A' ' 42' ' ' VAL . 10.2 m -142.55 81.61 1.74 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.401 179.566 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.716 HG11 HD12 ' A' ' 7' ' ' LEU . 12.3 p -41.95 -47.32 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.349 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.588 -179.693 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.506 ' N ' HG13 ' A' ' 39' ' ' VAL . 0.1 OUTLIER -60.27 -42.43 95.4 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 179.3 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.6 ' H ' HG22 ' A' ' 38' ' ' THR . . . -69.85 -47.59 46.59 Favored Glycine 0 N--CA 1.448 -0.546 0 C-N-CA 120.506 -0.854 . . . . 0.0 111.949 178.86 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.676 HG23 ' O ' ' A' ' 38' ' ' THR . 17.0 t -43.14 -41.97 1.24 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.163 0 CA-C-O 121.134 0.492 . . . . 0.0 110.548 179.239 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 2.6 t-105 -77.17 -32.65 56.34 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.762 -0.653 . . . . 0.0 111.02 179.325 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.7 m -80.52 -52.14 7.96 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 120.815 0.341 . . . . 0.0 111.072 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.896 HD23 ' HB2' ' A' ' 32' ' ' LEU . 0.4 OUTLIER -53.64 -34.2 57.76 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.922 179.445 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.532 ' HG3' ' HA ' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -69.17 -60.64 2.21 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.02 179.233 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -57.76 -30.82 65.93 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.169 179.659 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -77.01 -52.74 8.82 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.103 179.701 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.73 HG22 ' O ' ' A' ' 45' ' ' LEU . 4.9 tp -57.12 -24.09 20.0 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.22 0 C-N-CA 120.589 -0.444 . . . . 0.0 111.054 -179.846 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.547 HD13 ' HG3' ' A' ' 19' ' ' GLU . 1.5 tp -80.09 -35.14 37.32 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 178.735 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 50.2 m -57.68 -27.85 63.26 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.74 178.982 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.555 ' C ' ' CD1' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -87.89 13.41 10.9 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-O 120.782 0.325 . . . . 0.0 110.918 179.636 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.538 ' O ' HG23 ' A' ' 53' ' ' THR . 13.7 t -149.97 55.34 0.94 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.119 0.485 . . . . 0.0 111.344 -179.611 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.539 HG23 ' O ' ' A' ' 50' ' ' LEU . 40.1 t -127.75 -79.77 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.147 179.855 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 39.6 m -75.87 114.16 14.17 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.699 0.285 . . . . 0.0 110.588 -179.703 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.148 -0.93 . . . . 0.0 110.729 179.757 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' THR . . . . . 0.7 ' O ' HG23 ' A' ' 2' ' ' THR . 22.5 p . . . . . 0 N--CA 1.494 1.742 0 CA-C-O 121.36 0.6 . . . . 0.0 111.073 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.7 HG23 ' O ' ' A' ' 1' ' ' THR . 0.8 OUTLIER -168.22 -53.51 0.02 OUTLIER 'General case' 0 CA--C 1.521 -0.161 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.584 -179.92 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 3' ' ' TYR . . . . . 0.433 ' CG ' ' O ' ' A' ' 2' ' ' THR . 54.6 p90 44.23 29.96 0.41 Allowed 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.536 -179.357 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.62 78.79 0.71 Allowed 'General case' 0 N--CA 1.454 -0.23 0 CA-C-O 121.191 0.519 . . . . 0.0 110.697 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 18.3 mt -145.54 -177.54 5.62 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.923 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 1.9 pt -113.91 146.74 18.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.137 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -91.71 -58.95 2.25 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.928 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -177.86 48.1 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.675 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.788 ' HG ' HG21 ' A' ' 42' ' ' VAL . 4.6 tt -79.1 -43.12 24.75 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.18 -179.647 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -54.5 -36.67 64.45 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.51 179.769 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -87.04 -32.33 20.05 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.381 179.511 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.64 -37.24 78.14 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.481 179.408 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.624 ' HB3' HG11 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -85.1 -36.65 21.0 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.478 179.593 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.478 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 1.9 mm-40 -58.39 -50.39 73.86 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 178.949 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 56.5 tt0 -63.36 -34.55 77.97 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 177.786 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.564 ' CB ' HD12 ' A' ' 33' ' ' ILE . . . -63.57 -36.39 83.64 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 115.153 -0.93 . . . . 0.0 110.173 179.239 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.787 ' O ' HG23 ' A' ' 21' ' ' VAL . 20.4 mm -57.75 -49.17 81.73 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.139 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 178.762 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 20.4 mmtt -61.3 -33.14 73.08 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.97 178.651 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.594 ' HG3' HD13 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -59.01 -52.45 65.72 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.622 179.56 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.66 HD21 ' O ' ' A' ' 25' ' ' ILE . 0.2 OUTLIER -76.16 -29.81 57.87 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.537 179.772 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.787 HG23 ' O ' ' A' ' 17' ' ' ILE . 66.5 t -67.54 -31.2 51.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.959 0.409 . . . . 0.0 110.095 179.355 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -90.22 -33.84 16.03 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.191 179.423 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -84.66 -15.01 46.87 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.2 179.466 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.732 ' O ' HG23 ' A' ' 25' ' ' ILE . . . 40.4 86.19 0.01 OUTLIER Glycine 0 C--N 1.334 0.444 0 CA-C-N 116.299 -0.409 . . . . 0.0 113.645 179.576 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.732 HG23 ' O ' ' A' ' 24' ' ' GLY . 1.2 pp -172.66 138.54 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 CA-C-O 121.058 0.456 . . . . 0.0 112.033 179.53 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . 35.82 86.83 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 115.575 -0.739 . . . . 0.0 112.75 179.769 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.677 ' O ' HG22 ' A' ' 30' ' ' ILE . 1.3 mt-10 -61.66 -28.58 69.49 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.164 0.507 . . . . 0.0 109.669 178.606 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -45.92 -45.8 15.66 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.639 179.06 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.624 ' HA ' ' HG ' ' A' ' 32' ' ' LEU . 3.4 m-85 -65.58 -30.07 70.75 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.156 0.503 . . . . 0.0 110.284 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.677 HG22 ' O ' ' A' ' 27' ' ' GLU . 1.9 tt -61.8 -26.21 39.19 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 178.079 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.2 tppp? -76.33 -38.06 56.48 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.676 179.588 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.624 ' HG ' ' HA ' ' A' ' 29' ' ' TYR . 0.1 OUTLIER -59.72 -33.57 71.8 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 120.117 -0.633 . . . . 0.0 109.92 179.445 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.564 HD12 ' CB ' ' A' ' 16' ' ' ALA . 4.7 pt -90.18 -48.41 14.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.795 179.397 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -56.28 -28.07 57.48 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.95 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 20.9 t30 -91.54 -15.57 28.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.159 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.725 ' CB ' HD21 ' A' ' 9' ' ' LEU . . . 60.58 -162.81 0.26 Allowed 'General case' 0 C--N 1.333 -0.11 0 CA-C-O 120.499 0.19 . . . . 0.0 111.005 179.673 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.564 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 6.3 tttt 138.14 -52.97 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 123.786 0.834 . . . . 0.0 109.081 -179.478 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.66 ' O ' HG23 ' A' ' 42' ' ' VAL . 1.0 OUTLIER -129.24 101.74 6.14 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.333 -0.849 . . . . 0.0 109.847 178.946 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.542 ' N ' HD12 ' A' ' 9' ' ' LEU . 10.4 p -42.39 -38.09 0.77 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.326 0 CA-C-O 121.301 0.572 . . . . 0.0 110.81 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -69.84 -44.99 68.77 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.469 -0.787 . . . . 0.0 109.701 179.239 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -63.75 -45.16 95.08 Favored Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 120.349 -0.929 . . . . 0.0 111.335 178.745 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.788 HG21 ' HG ' ' A' ' 9' ' ' LEU . 11.7 t -48.18 -41.84 10.57 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-O 121.194 0.521 . . . . 0.0 110.008 178.919 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 48.2 t90 -77.34 -27.81 52.85 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.529 -0.76 . . . . 0.0 111.097 179.379 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.8 m -80.8 -48.84 11.9 Favored 'General case' 0 C--N 1.334 -0.107 0 CA-C-O 120.814 0.34 . . . . 0.0 111.035 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.731 ' O ' HG22 ' A' ' 49' ' ' ILE . 4.0 mm? -58.61 -34.75 71.49 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.103 179.56 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.456 ' HD2' ' HB2' ' A' ' 16' ' ' ALA . 12.2 tttm -68.46 -59.89 2.83 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.63 -0.713 . . . . 0.0 110.305 179.379 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -58.47 -31.03 67.44 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.361 179.681 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -77.1 -53.12 8.18 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.835 -0.621 . . . . 0.0 111.081 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.731 HG22 ' O ' ' A' ' 45' ' ' LEU . 4.6 tp -57.49 -23.91 20.77 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.143 0 C-N-CA 120.824 -0.35 . . . . 0.0 111.179 -179.872 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.594 HD13 ' HG3' ' A' ' 19' ' ' GLU . 2.0 tp -81.69 -32.34 31.75 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.692 -0.484 . . . . 0.0 109.692 178.782 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.449 ' HA ' ' CG2' ' A' ' 54' ' ' VAL . 17.0 m -64.79 -23.74 67.34 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.706 179.767 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.602 ' CD1' HD12 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -83.45 16.7 2.45 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 121.245 0.545 . . . . 0.0 111.351 179.871 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.65 ' O ' HG22 ' A' ' 53' ' ' THR . 3.1 m -175.7 69.36 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 108.469 -0.937 . . . . 0.0 108.469 178.955 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.511 HG13 ' O ' ' A' ' 50' ' ' LEU . 0.0 OUTLIER -128.36 -81.25 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.381 -0.827 . . . . 0.0 111.42 -178.362 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.6 m 68.78 151.88 0.09 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.966 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 59.1 mt-10 . . . . . 0 C--O 1.246 0.888 0 CA-C-O 118.4 -0.809 . . . . 0.0 110.825 179.984 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 62.1 m . . . . . 0 N--CA 1.491 1.62 0 CA-C-O 120.701 0.286 . . . . 0.0 111.143 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 14.9 p -132.62 143.2 49.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.209 179.854 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' TYR . . . . . 0.717 ' HB2' HD13 ' A' ' 5' ' ' LEU . 9.2 p90 -116.24 -38.95 3.47 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.563 179.857 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.453 ' C ' HD12 ' A' ' 5' ' ' LEU . 0.0 OUTLIER 62.79 66.58 0.75 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.843 179.782 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.717 HD13 ' HB2' ' A' ' 3' ' ' TYR . 5.5 mp -139.71 -55.89 0.56 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.951 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.772 HG22 ' HG ' ' A' ' 7' ' ' LEU . 20.7 mt -117.18 140.44 39.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.936 -179.566 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.772 ' HG ' HG22 ' A' ' 6' ' ' ILE . 20.6 mt 66.99 -171.22 0.19 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.399 179.762 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 12.4 t30 178.82 49.77 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.96 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.726 HD21 ' CB ' ' A' ' 36' ' ' ALA . 6.5 tt -76.28 -46.37 28.19 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.43 -179.095 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 4.9 mtpt -52.92 -37.79 61.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.8 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -87.52 -29.13 21.56 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.861 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.58 -36.62 84.39 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.196 179.497 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.699 ' O ' HD13 ' A' ' 17' ' ' ILE . 0.0 OUTLIER -85.27 -36.38 20.92 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.903 179.549 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.462 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 5.4 pt-20 -59.87 -50.11 75.08 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 179.159 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.443 ' N ' ' CG ' ' A' ' 14' ' ' GLU . 1.1 tp10 -65.0 -36.32 84.04 Favored 'General case' 0 CA--C 1.516 -0.345 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 178.183 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.458 ' HB1' HD13 ' A' ' 33' ' ' ILE . . . -64.45 -34.29 77.86 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 115.234 -0.893 . . . . 0.0 110.308 179.461 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.751 ' O ' HG23 ' A' ' 21' ' ' VAL . 1.3 mp -59.81 -45.83 94.37 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.277 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 178.808 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 11.3 mttt -65.46 -33.07 75.09 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.56 -0.746 . . . . 0.0 109.966 178.629 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.597 ' HG3' HD13 ' A' ' 50' ' ' LEU . 0.5 OUTLIER -56.88 -52.58 64.57 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.315 179.996 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.883 HD22 HG13 ' A' ' 30' ' ' ILE . 0.2 OUTLIER -77.63 -32.76 53.63 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.768 0.318 . . . . 0.0 110.711 -179.859 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.751 HG23 ' O ' ' A' ' 17' ' ' ILE . 55.6 t -62.82 -31.39 52.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-O 120.87 0.367 . . . . 0.0 110.203 179.464 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -90.82 -36.98 13.91 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.2 179.368 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -77.07 -14.92 59.75 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.072 179.367 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.408 ' N ' ' O ' ' A' ' 20' ' ' LEU . . . 49.71 100.99 0.01 OUTLIER Glycine 0 CA--C 1.523 0.533 0 C-N-CA 121.185 -0.531 . . . . 0.0 113.274 179.447 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.564 HG21 ' CE1' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -168.84 -169.55 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.253 0 CA-C-N 117.029 0.415 . . . . 0.0 111.403 179.345 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -43.24 95.33 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.006 -0.543 . . . . 0.0 112.143 -179.401 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.415 ' O ' ' N ' ' A' ' 30' ' ' ILE . 0.6 OUTLIER -52.61 -25.9 11.97 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.292 0.568 . . . . 0.0 110.513 179.107 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.4 ' O ' ' HB3' ' A' ' 31' ' ' LYS . 1.9 tptm -46.3 -44.91 17.01 Favored 'General case' 0 C--O 1.238 0.493 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.168 179.067 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.79 ' CG ' HD13 ' A' ' 49' ' ' ILE . 2.7 m-85 -61.46 -31.8 71.78 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.003 179.72 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.883 HG13 HD22 ' A' ' 20' ' ' LEU . 43.6 mt -60.65 -26.47 38.06 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.331 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 177.97 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.4 ' HB3' ' O ' ' A' ' 28' ' ' LYS . 0.1 OUTLIER -74.98 -37.32 61.94 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.694 179.429 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.607 ' HG ' ' HA ' ' A' ' 29' ' ' TYR . 0.1 OUTLIER -60.52 -33.37 72.55 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 120.03 -0.668 . . . . 0.0 109.841 179.55 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.636 HG22 ' HA ' ' A' ' 42' ' ' VAL . 3.7 pt -91.72 -46.69 14.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.987 179.619 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.447 ' HB2' HD11 ' A' ' 17' ' ' ILE . . . -58.71 -29.51 66.73 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.741 -179.949 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 -85.06 -12.91 51.96 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.921 179.841 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.726 ' CB ' HD21 ' A' ' 9' ' ' LEU . . . 58.59 -139.9 0.76 Allowed 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 116.656 -0.247 . . . . 0.0 110.97 179.445 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.545 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 0.4 OUTLIER 95.68 -27.12 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 122.797 0.439 . . . . 0.0 110.796 -179.855 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.707 ' O ' HG23 ' A' ' 42' ' ' VAL . 55.5 p -143.65 83.14 1.75 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.624 179.671 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.644 ' CA ' HD12 ' A' ' 9' ' ' LEU . 8.1 p -40.63 -48.85 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.494 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.531 ' N ' HG13 ' A' ' 39' ' ' VAL . 30.0 mm-40 -61.58 -41.45 97.43 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.283 -0.417 . . . . 0.0 109.957 179.61 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -68.03 -47.12 61.56 Favored Glycine 0 N--CA 1.448 -0.555 0 C-N-CA 120.519 -0.848 . . . . 0.0 111.788 178.733 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.707 HG23 ' O ' ' A' ' 38' ' ' THR . 11.9 t -43.8 -41.9 1.65 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.164 0 CA-C-O 121.276 0.56 . . . . 0.0 110.254 179.026 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 73.7 t-105 -78.3 -31.26 48.76 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.549 -0.751 . . . . 0.0 111.304 179.333 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.9 m -79.12 -49.2 12.98 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.84 0.352 . . . . 0.0 110.959 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.687 ' O ' HG22 ' A' ' 49' ' ' ILE . 1.8 mt -56.88 -34.9 68.32 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.064 -0.516 . . . . 0.0 109.928 179.459 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.447 ' HB2' ' CB ' ' A' ' 16' ' ' ALA . 12.8 tttm -67.87 -59.82 2.99 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.479 179.486 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.74 -32.64 69.41 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.497 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -76.19 -53.65 7.96 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.918 179.885 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.79 HD13 ' CG ' ' A' ' 29' ' ' TYR . 9.1 tp -58.41 -24.4 24.85 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.152 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.162 -179.73 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.597 HD13 ' HG3' ' A' ' 19' ' ' GLU . 4.1 tp -78.87 -34.54 44.86 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 178.753 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 35.6 m -58.35 -34.82 71.07 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.913 179.354 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.794 ' CG ' ' O ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -75.12 57.96 0.87 Allowed 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 121.577 0.703 . . . . 0.0 110.76 179.979 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.412 HG22 ' N ' ' A' ' 54' ' ' VAL . 1.1 m 170.44 -64.34 0.01 OUTLIER 'General case' 0 C--O 1.231 0.117 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 179.839 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.624 ' O ' HG23 ' A' ' 55' ' ' THR . 2.7 t -77.6 75.15 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.661 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.277 179.707 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.624 HG23 ' O ' ' A' ' 54' ' ' VAL . 0.1 OUTLIER 170.03 -65.22 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.623 -179.864 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 . . . . . 0 C--O 1.25 1.107 0 CA-C-O 118.205 -0.902 . . . . 0.0 110.817 179.943 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 3.1 p . . . . . 0 N--CA 1.487 1.394 0 CA-C-O 120.987 0.422 . . . . 0.0 111.109 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.475 ' HB ' HD11 ' A' ' 5' ' ' LEU . 0.1 OUTLIER -146.1 144.08 29.77 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.001 0.429 . . . . 0.0 110.973 179.671 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -98.15 34.95 1.83 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.05 179.694 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.445 ' C ' HD12 ' A' ' 5' ' ' LEU . 1.1 tmtt? -149.72 84.2 1.41 Allowed 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.84 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.475 HD11 ' HB ' ' A' ' 2' ' ' THR . 5.0 mp -150.38 167.88 25.77 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.717 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.51 HD11 ' CB ' ' A' ' 9' ' ' LEU . 0.5 OUTLIER -145.51 -44.68 0.12 Allowed 'Isoleucine or valine' 0 C--O 1.223 -0.301 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.45 179.738 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 39.8 tp -167.01 -77.94 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.816 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 21.7 p30 -162.14 40.38 0.13 Allowed 'General case' 0 N--CA 1.454 -0.261 0 CA-C-O 120.929 0.395 . . . . 0.0 110.767 -179.682 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.744 HD21 ' CB ' ' A' ' 36' ' ' ALA . 4.0 tt -80.09 -47.73 14.35 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.643 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.454 ' N ' HD23 ' A' ' 9' ' ' LEU . 3.7 mtmp? -54.18 -32.68 56.18 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.562 179.641 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.429 ' O ' ' HG2' ' A' ' 14' ' ' GLU . 0.8 OUTLIER -87.7 -32.94 18.93 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.55 179.551 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.62 -36.75 76.95 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.269 179.368 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.637 ' HB3' HG11 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -85.04 -37.99 19.71 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.592 179.406 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.489 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 4.5 pt-20 -56.36 -49.56 74.07 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 178.902 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.424 ' N ' ' CG ' ' A' ' 14' ' ' GLU . 60.4 tt0 -63.38 -34.01 76.8 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 177.64 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.605 ' HB1' ' CD1' ' A' ' 33' ' ' ILE . . . -63.71 -39.53 94.52 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 115.143 -0.935 . . . . 0.0 109.968 179.073 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.773 ' O ' HG23 ' A' ' 21' ' ' VAL . 28.8 mm -55.61 -49.69 72.12 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.2 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 178.523 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.6 -32.15 70.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.304 -0.862 . . . . 0.0 109.695 178.399 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.648 ' CG ' HD13 ' A' ' 50' ' ' LEU . 0.2 OUTLIER -65.97 -52.47 49.29 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.637 179.533 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.733 HD22 ' HB ' ' A' ' 30' ' ' ILE . 0.3 OUTLIER -71.74 -32.97 68.31 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.392 179.768 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.773 HG23 ' O ' ' A' ' 17' ' ' ILE . 65.4 t -63.87 -31.44 53.18 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.207 0 CA-C-N 116.311 -0.404 . . . . 0.0 109.973 179.113 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -85.19 -38.4 19.03 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.946 179.199 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.754 ' CB ' HD11 ' A' ' 25' ' ' ILE . . . -76.1 -15.09 60.16 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.968 179.267 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.412 ' C ' HG13 ' A' ' 25' ' ' ILE . . . 39.81 89.8 0.01 OUTLIER Glycine 0 CA--C 1.523 0.552 0 CA-C-N 116.144 -0.48 . . . . 0.0 114.243 179.019 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.754 HD11 ' CB ' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -153.43 -167.65 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.268 0 CA-C-N 116.78 0.29 . . . . 0.0 110.702 179.028 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.446 ' HB3' ' CE2' ' A' ' 29' ' ' TYR . . . -46.65 97.22 0.01 OUTLIER 'General case' 0 C--O 1.232 0.149 0 CA-C-O 120.927 0.394 . . . . 0.0 111.344 -179.6 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.588 ' O ' HG22 ' A' ' 30' ' ' ILE . 0.2 OUTLIER -45.28 -25.43 0.38 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.268 179.574 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -40.95 -48.23 3.13 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 121.436 0.636 . . . . 0.0 110.839 179.463 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.594 ' HA ' ' HG ' ' A' ' 32' ' ' LEU . 58.1 m-85 -60.63 -33.65 73.09 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.14 179.87 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.733 ' HB ' HD22 ' A' ' 20' ' ' LEU . 1.8 tt -60.39 -26.29 36.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.641 -0.709 . . . . 0.0 109.676 178.392 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.32 -36.88 58.07 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.761 179.598 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.617 HD12 HD12 ' A' ' 45' ' ' LEU . 0.1 OUTLIER -58.88 -33.9 71.03 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 120.229 -0.588 . . . . 0.0 109.634 179.315 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.605 ' CD1' ' HB1' ' A' ' 16' ' ' ALA . 2.5 pt -91.75 -46.43 14.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.723 179.266 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -58.44 -29.5 66.18 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.757 -179.794 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 25.6 t30 -84.95 -16.32 41.39 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.015 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.744 ' CB ' HD21 ' A' ' 9' ' ' LEU . . . 59.07 -136.93 0.81 Allowed 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.137 179.505 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.539 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 25.0 tttt 95.29 -27.32 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 122.851 0.46 . . . . 0.0 110.667 -179.478 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.66 ' O ' HG23 ' A' ' 42' ' ' VAL . 60.1 p -142.25 83.68 1.84 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.332 179.522 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.533 HG13 ' N ' ' A' ' 40' ' ' GLU . 8.6 p -39.57 -49.45 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.566 -179.726 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.533 ' N ' HG13 ' A' ' 39' ' ' VAL . 0.1 OUTLIER -61.62 -43.17 99.35 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.873 -0.418 . . . . 0.0 109.873 179.289 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -65.75 -46.13 84.94 Favored Glycine 0 N--CA 1.447 -0.568 0 C-N-CA 120.447 -0.883 . . . . 0.0 111.724 178.923 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.66 HG23 ' O ' ' A' ' 38' ' ' THR . 14.6 t -45.44 -41.6 3.09 Favored 'Isoleucine or valine' 0 C--O 1.233 0.217 0 CA-C-O 121.126 0.489 . . . . 0.0 110.261 179.048 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 69.1 t90 -77.2 -30.57 54.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.0 179.382 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.4 m -79.39 -49.15 12.8 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 120.804 0.335 . . . . 0.0 110.91 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.759 ' O ' HG22 ' A' ' 49' ' ' ILE . 3.5 mm? -56.78 -36.03 69.38 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.239 179.4 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.521 ' HD3' ' HB2' ' A' ' 16' ' ' ALA . 15.5 ttpp -67.83 -58.85 3.89 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.604 179.523 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.48 -32.37 68.7 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.293 179.789 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 17.1 tt0 -77.22 -53.52 7.63 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.981 179.815 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.759 HG22 ' O ' ' A' ' 45' ' ' LEU . 3.6 tp -56.61 -23.97 18.26 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.289 0 C-N-CA 120.902 -0.319 . . . . 0.0 111.217 -179.773 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.648 HD13 ' CG ' ' A' ' 19' ' ' GLU . 1.8 tp -81.65 -33.32 31.41 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 178.766 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.435 ' HA ' ' CG2' ' A' ' 54' ' ' VAL . 17.1 m -64.43 -18.52 64.81 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.66 179.41 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.574 ' CD1' ' O ' ' A' ' 49' ' ' ILE . 0.0 OUTLIER -88.19 36.02 0.77 Allowed 'General case' 0 CA--C 1.531 0.223 0 CA-C-O 121.338 0.589 . . . . 0.0 111.361 -179.709 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.417 ' OG1' ' O ' ' A' ' 52' ' ' PHE . 2.4 m 176.25 -67.9 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.09 179.418 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.542 HG23 ' O ' ' A' ' 50' ' ' LEU . 70.9 t 53.44 102.35 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 CA-C-N 115.736 -0.666 . . . . 0.0 111.46 179.254 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -75.52 113.8 13.34 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.662 -179.771 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 . . . . . 0 C--O 1.249 1.079 0 CA-C-O 118.25 -0.881 . . . . 0.0 110.87 -179.983 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 7.5 t . . . . . 0 N--CA 1.486 1.329 0 CA-C-O 120.711 0.291 . . . . 0.0 111.144 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.4 ' OG1' HD11 ' A' ' 5' ' ' LEU . 0.6 OUTLIER -147.18 129.88 16.06 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-O 120.999 0.428 . . . . 0.0 110.895 -179.869 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 47.5 p90 -98.43 40.56 1.18 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.842 -179.763 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -151.3 73.33 1.09 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.987 -179.762 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.4 HD11 ' OG1' ' A' ' 2' ' ' THR . 2.5 mp -143.5 -45.91 0.28 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.949 179.816 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 1.1 pt -79.96 143.99 11.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 121.087 0.47 . . . . 0.0 110.911 -179.908 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.645 ' CD2' HG21 ' A' ' 39' ' ' VAL . 0.8 OUTLIER -171.11 -170.83 0.89 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.891 -179.857 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ASN . . . . . 0.436 ' O ' ' HB2' ' A' ' 12' ' ' ALA . 1.8 t-20 -152.95 36.12 0.48 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.673 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.728 HD21 ' CB ' ' A' ' 36' ' ' ALA . 6.8 tt -84.82 -48.46 9.34 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.118 -179.595 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.425 ' HA ' ' HD3' ' A' ' 13' ' ' LYS . 45.9 tttp -52.79 -35.34 56.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.901 179.874 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.406 ' O ' ' HG3' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -87.37 -32.85 19.37 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.62 179.825 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.436 ' HB2' ' O ' ' A' ' 8' ' ' ASN . . . -58.91 -37.99 77.91 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.314 179.344 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.664 ' HB3' HG11 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -85.38 -35.4 21.38 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.784 -0.643 . . . . 0.0 111.021 179.754 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.619 ' O ' HG22 ' A' ' 17' ' ' ILE . 0.3 OUTLIER -58.52 -42.18 87.12 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 121.505 0.669 . . . . 0.0 109.299 179.086 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -72.75 -31.1 64.67 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.311 -0.859 . . . . 0.0 108.89 177.864 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.691 ' HB1' ' CD1' ' A' ' 33' ' ' ILE . . . -69.63 -42.44 74.32 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.184 -0.917 . . . . 0.0 111.335 179.903 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.683 ' O ' HG23 ' A' ' 21' ' ' VAL . 2.2 tp -61.6 -37.35 77.69 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.243 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 179.085 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.64 -32.46 71.16 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 177.491 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.59 ' CG ' HD13 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -62.03 -52.68 63.0 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.999 179.479 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.506 ' HG ' HG13 ' A' ' 25' ' ' ILE . 0.2 OUTLIER -74.95 -35.02 62.13 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.133 -179.442 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.683 HG23 ' O ' ' A' ' 17' ' ' ILE . 41.8 t -63.58 -31.25 52.24 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-O 120.838 0.351 . . . . 0.0 110.284 179.493 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -91.69 -33.12 15.18 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.638 179.571 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.77 ' HB1' HG21 ' A' ' 53' ' ' THR . . . -82.48 -15.05 53.91 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.579 179.858 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.714 ' O ' HG23 ' A' ' 25' ' ' ILE . . . 48.76 105.02 0.01 OUTLIER Glycine 0 CA--C 1.524 0.643 0 C-N-CA 121.136 -0.554 . . . . 0.0 113.104 179.607 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.714 HG23 ' O ' ' A' ' 24' ' ' GLY . 0.7 OUTLIER -177.43 -173.67 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.199 0 CA-C-N 117.213 0.506 . . . . 0.0 111.709 179.715 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -37.03 95.15 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 115.964 -0.562 . . . . 0.0 112.358 -179.15 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.438 ' O ' ' N ' ' A' ' 30' ' ' ILE . 9.8 tt0 -54.92 -25.36 28.76 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.559 179.143 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.8 tptm -44.63 -47.94 10.46 Favored 'General case' 0 C--O 1.239 0.51 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.699 179.389 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.611 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 2.7 m-85 -64.34 -30.39 71.44 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.278 0.561 . . . . 0.0 109.855 179.582 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.63 ' CD1' HD12 ' A' ' 17' ' ' ILE . 0.6 OUTLIER -61.58 -26.4 39.51 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 CA-C-N 115.846 -0.615 . . . . 0.0 109.402 178.056 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -75.88 -38.06 58.25 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.73 179.524 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.735 ' HB2' HD13 ' A' ' 45' ' ' LEU . 0.0 OUTLIER -61.02 -32.0 71.61 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 119.962 -0.695 . . . . 0.0 109.876 179.528 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.691 ' CD1' ' HB1' ' A' ' 16' ' ' ALA . 4.1 pt -91.7 -46.47 14.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.986 179.334 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -58.74 -29.03 66.41 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.807 -179.735 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -89.15 -16.43 31.42 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.963 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.728 ' CB ' HD21 ' A' ' 9' ' ' LEU . . . 62.52 -139.98 0.42 Allowed 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 116.682 -0.236 . . . . 0.0 111.007 179.603 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.537 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 0.0 OUTLIER 95.83 -27.63 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 122.818 0.447 . . . . 0.0 110.712 -179.73 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.692 ' O ' HG23 ' A' ' 42' ' ' VAL . 0.2 OUTLIER -140.88 83.14 1.87 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.435 179.618 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.645 HG21 ' CD2' ' A' ' 7' ' ' LEU . 9.2 p -40.93 -48.64 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.4 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.501 -179.849 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.52 ' N ' HG13 ' A' ' 39' ' ' VAL . 0.6 OUTLIER -62.11 -41.11 97.89 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 179.533 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -67.7 -47.11 63.43 Favored Glycine 0 N--CA 1.448 -0.511 0 C-N-CA 120.483 -0.865 . . . . 0.0 111.84 178.896 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.692 HG23 ' O ' ' A' ' 38' ' ' THR . 7.4 t -45.12 -40.43 2.32 Favored 'Isoleucine or valine' 0 C--O 1.232 0.139 0 CA-C-O 121.23 0.538 . . . . 0.0 110.198 179.161 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 60.8 t-105 -77.98 -31.52 50.8 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.985 179.186 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.8 m -78.66 -53.7 6.89 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.867 0.365 . . . . 0.0 110.988 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.737 ' O ' HG22 ' A' ' 49' ' ' ILE . 3.3 mt -55.14 -34.47 63.79 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.307 179.66 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.434 ' HB2' ' HB2' ' A' ' 16' ' ' ALA . 4.9 tttm -67.48 -58.64 4.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.229 179.446 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -60.5 -30.16 69.54 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.392 179.792 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -78.5 -53.15 7.53 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.109 179.847 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.737 HG22 ' O ' ' A' ' 45' ' ' LEU . 4.4 tp -55.69 -24.14 15.96 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.122 0 C-N-CA 120.961 -0.296 . . . . 0.0 110.912 -179.906 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.59 HD13 ' CG ' ' A' ' 19' ' ' GLU . 0.7 OUTLIER -82.39 -33.45 28.71 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 178.523 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 24.2 m -59.21 -24.93 63.56 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.13 179.172 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.579 ' CG ' ' O ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -86.84 19.59 2.92 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-O 121.139 0.495 . . . . 0.0 111.078 179.94 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.77 HG21 ' HB1' ' A' ' 23' ' ' ALA . 5.3 t -148.12 53.96 1.03 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.049 0.452 . . . . 0.0 111.369 179.374 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 20.9 t -145.24 115.41 1.75 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.191 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -133.61 72.51 1.48 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.829 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.248 0.996 0 CA-C-O 118.089 -0.958 . . . . 0.0 110.959 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 74.5 p . . . . . 0 N--CA 1.49 1.563 0 CA-C-O 120.989 0.423 . . . . 0.0 111.197 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 1.6 p -76.3 -59.65 2.68 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.827 -179.638 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER 58.86 22.79 10.61 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.865 -179.913 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -169.89 103.03 0.31 Allowed 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.66 180.0 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.665 HD22 ' N ' ' A' ' 5' ' ' LEU . 1.2 mm? -98.95 113.27 25.35 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.07 0.462 . . . . 0.0 110.826 -179.391 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.598 HG22 ' O ' ' A' ' 6' ' ' ILE . 24.3 mt 69.63 9.48 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.453 -0.28 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.889 179.459 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 50.81 -169.0 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.701 0.286 . . . . 0.0 111.002 179.762 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -134.46 -49.68 0.78 Allowed 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 116.528 -0.306 . . . . 0.0 111.702 179.423 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.718 HD21 ' CB ' ' A' ' 36' ' ' ALA . 8.9 tt -52.19 -48.93 64.78 Favored 'General case' 0 N--CA 1.456 -0.132 0 CA-C-O 121.003 0.43 . . . . 0.0 111.272 179.738 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.471 ' HA ' ' HD3' ' A' ' 13' ' ' LYS . 1.3 ttpp -52.89 -35.32 57.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.957 -179.852 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.89 -29.15 19.84 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.872 -179.988 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.34 -37.59 87.87 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.143 179.374 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.573 ' HB3' HG11 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -85.42 -35.49 21.26 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.96 179.712 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.799 ' O ' HG22 ' A' ' 17' ' ' ILE . 0.3 OUTLIER -60.03 -44.91 94.3 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.43 0.633 . . . . 0.0 109.312 179.206 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.4 ' N ' ' HG3' ' A' ' 14' ' ' GLU . 0.9 OUTLIER -70.18 -31.05 68.34 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.531 -0.758 . . . . 0.0 109.05 177.967 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.567 ' HB1' ' CD1' ' A' ' 33' ' ' ILE . . . -71.19 -38.32 72.09 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.221 -0.9 . . . . 0.0 111.329 -179.886 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.799 HG22 ' O ' ' A' ' 14' ' ' GLU . 1.7 tp -63.51 -34.87 70.13 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.289 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 179.338 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.5 mmmp? -72.26 -32.32 66.55 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 109.082 -0.71 . . . . 0.0 109.082 177.667 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.511 ' HB3' HD13 ' A' ' 50' ' ' LEU . 0.5 OUTLIER -63.77 -52.72 59.08 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.22 -0.9 . . . . 0.0 111.076 179.745 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.704 HD22 ' HB ' ' A' ' 30' ' ' ILE . 0.2 OUTLIER -73.93 -35.82 64.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.212 -179.52 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.626 HG23 ' O ' ' A' ' 17' ' ' ILE . 33.0 t -63.29 -31.17 51.79 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-O 120.833 0.349 . . . . 0.0 110.32 179.552 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -90.04 -34.08 16.08 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.506 179.605 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.949 ' HB1' HG21 ' A' ' 53' ' ' THR . . . -80.23 -15.12 57.71 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.534 179.723 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.597 ' O ' HG23 ' A' ' 25' ' ' ILE . . . 46.09 94.81 0.01 OUTLIER Glycine 0 CA--C 1.522 0.471 0 C-N-CA 121.001 -0.619 . . . . 0.0 113.237 179.724 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.738 ' N ' HD13 ' A' ' 25' ' ' ILE . 0.1 OUTLIER -160.63 -172.15 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.333 -0.13 0 CA-C-N 116.752 0.276 . . . . 0.0 111.239 179.87 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -41.47 94.75 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.948 -179.607 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.567 ' O ' HG22 ' A' ' 30' ' ' ILE . 0.0 OUTLIER -50.88 -25.61 4.76 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.623 179.59 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -45.89 -46.95 16.17 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-O 121.303 0.573 . . . . 0.0 110.548 179.195 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.68 ' HA ' ' HG ' ' A' ' 32' ' ' LEU . 3.0 m-85 -64.19 -29.78 70.87 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.279 0.562 . . . . 0.0 109.895 179.688 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.704 ' HB ' HD22 ' A' ' 20' ' ' LEU . 1.0 OUTLIER -62.38 -26.44 40.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.379 177.934 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -75.3 -36.05 61.19 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.403 179.373 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.68 ' HG ' ' HA ' ' A' ' 29' ' ' TYR . 0.2 OUTLIER -60.4 -34.66 74.24 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 120.263 -0.575 . . . . 0.0 109.826 179.146 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.567 ' CD1' ' HB1' ' A' ' 16' ' ' ALA . 5.5 pt -89.99 -46.33 15.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.943 179.414 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -61.11 -29.62 69.87 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.952 -179.46 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 33.1 t30 -84.99 -20.84 29.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.017 179.9 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.718 ' CB ' HD21 ' A' ' 9' ' ' LEU . . . 63.37 -140.01 0.35 Allowed 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.976 179.609 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.495 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 1.5 tpmp? 90.14 -22.38 0.11 Allowed 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 122.607 0.363 . . . . 0.0 111.221 -179.76 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.715 ' O ' HG23 ' A' ' 42' ' ' VAL . 0.8 OUTLIER -143.37 79.03 1.62 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.586 -0.279 . . . . 0.0 110.617 179.611 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.621 ' CA ' HD12 ' A' ' 9' ' ' LEU . 11.6 p -38.8 -49.05 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.445 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.767 -179.681 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.531 ' N ' HG13 ' A' ' 39' ' ' VAL . 0.2 OUTLIER -59.72 -47.53 85.27 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 179.511 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.47 ' O ' HD23 ' A' ' 45' ' ' LEU . . . -66.62 -40.25 94.02 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.412 -0.899 . . . . 0.0 112.452 179.269 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.715 HG23 ' O ' ' A' ' 38' ' ' THR . 21.4 t -47.07 -48.65 8.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 117.114 0.457 . . . . 0.0 110.56 179.627 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.467 ' CD1' ' HA ' ' A' ' 40' ' ' GLU . 15.4 p-90 -77.27 -26.16 52.15 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.444 179.617 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.8 m -79.68 -42.16 25.33 Favored 'General case' 0 N--CA 1.462 0.167 0 C-N-CA 120.599 -0.44 . . . . 0.0 110.983 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.725 ' O ' HG22 ' A' ' 49' ' ' ILE . 3.8 mm? -62.64 -33.77 75.71 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.133 -0.485 . . . . 0.0 109.846 179.405 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.463 ' HA ' HG22 ' A' ' 49' ' ' ILE . 8.6 ttpt -68.89 -62.12 1.52 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.229 179.292 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -55.7 -28.79 57.58 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.343 179.752 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -80.03 -54.72 5.52 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-N 115.828 -0.623 . . . . 0.0 110.713 179.589 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.725 HG22 ' O ' ' A' ' 45' ' ' LEU . 7.0 tp -58.69 -23.99 24.68 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.187 0 CA-C-O 120.86 0.362 . . . . 0.0 110.856 179.839 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.511 HD13 ' HB3' ' A' ' 19' ' ' GLU . 2.3 tp -80.3 -33.42 37.61 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.268 -0.642 . . . . 0.0 109.268 178.375 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 29.3 m -58.21 -29.71 65.91 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.783 179.085 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.627 ' HD1' ' O ' ' A' ' 49' ' ' ILE . 0.0 OUTLIER -82.3 12.28 4.56 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-O 120.89 0.376 . . . . 0.0 111.037 179.576 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.949 HG21 ' HB1' ' A' ' 23' ' ' ALA . 2.8 t -148.06 54.28 1.03 Allowed 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 121.204 0.526 . . . . 0.0 111.187 179.454 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.416 ' O ' ' N ' ' A' ' 56' ' ' GLU . 21.3 t -124.96 105.49 15.12 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.3 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.269 179.913 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.409 ' HG1' ' C ' ' A' ' 54' ' ' VAL . 3.2 p 52.12 -86.81 0.01 OUTLIER 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.449 -179.6 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.416 ' N ' ' O ' ' A' ' 54' ' ' VAL . 2.4 mt-10 . . . . . 0 C--O 1.25 1.111 0 CA-C-O 118.191 -0.909 . . . . 0.0 110.881 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 1' ' ' THR . . . . . 0.433 ' O ' HG23 ' A' ' 2' ' ' THR . 19.6 m . . . . . 0 N--CA 1.485 1.285 0 CA-C-O 120.952 0.406 . . . . 0.0 111.052 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.433 HG23 ' O ' ' A' ' 1' ' ' THR . 0.1 OUTLIER -167.74 -57.34 0.02 OUTLIER 'General case' 0 C--O 1.235 0.294 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.438 -179.883 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER 57.64 22.85 8.71 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.739 -179.79 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 5.1 ttpt -159.28 -44.67 0.05 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.924 179.934 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.3 mp 63.61 141.9 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.365 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.509 ' O ' ' HB2' ' A' ' 7' ' ' LEU . 0.9 OUTLIER -179.91 -42.95 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.135 179.767 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.773 ' HB3' HG21 ' A' ' 39' ' ' VAL . 2.8 mm? 75.26 -16.89 0.54 Allowed 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 115.767 -0.651 . . . . 0.0 112.47 179.8 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ASN . . . . . 0.543 ' O ' ' HB2' ' A' ' 12' ' ' ALA . 0.8 OUTLIER 79.78 34.91 0.16 Allowed 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 121.289 0.566 . . . . 0.0 110.062 -179.444 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 1.057 HD23 HG21 ' A' ' 42' ' ' VAL . 0.1 OUTLIER -85.16 -48.74 8.85 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.696 -179.704 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.817 ' N ' HD13 ' A' ' 9' ' ' LEU . 0.0 OUTLIER -56.82 -35.29 68.61 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.017 -179.969 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.3 -38.07 16.6 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.937 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.543 ' HB2' ' O ' ' A' ' 8' ' ' ASN . . . -56.37 -37.42 70.04 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.645 179.623 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.666 ' HB3' HG11 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -85.19 -35.38 21.69 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.679 179.587 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.454 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 3.0 mm-40 -59.44 -50.43 73.97 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 179.059 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -63.77 -36.83 85.19 Favored 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 108.925 -0.768 . . . . 0.0 108.925 178.033 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.541 ' HB1' HD13 ' A' ' 33' ' ' ILE . . . -64.21 -35.04 79.5 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-N 115.092 -0.958 . . . . 0.0 110.346 179.483 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.82 ' O ' HG23 ' A' ' 21' ' ' VAL . 1.4 mp -58.62 -47.44 88.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 178.965 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 4.6 mmmt -63.13 -33.12 74.77 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.936 178.59 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.611 ' HB3' HD13 ' A' ' 50' ' ' LEU . 0.2 OUTLIER -57.77 -52.49 65.25 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.873 179.618 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.956 HD22 HG13 ' A' ' 30' ' ' ILE . 0.2 OUTLIER -76.06 -30.63 58.44 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.703 -0.399 . . . . 0.0 110.37 179.77 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.82 HG23 ' O ' ' A' ' 17' ' ' ILE . 53.1 t -62.76 -31.28 51.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 178.733 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -86.91 -39.89 15.34 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.878 178.975 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.804 ' CB ' HD11 ' A' ' 25' ' ' ILE . . . -73.91 -15.05 61.15 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.795 179.033 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.424 ' C ' HG13 ' A' ' 25' ' ' ILE . . . 43.48 77.69 0.08 OUTLIER Glycine 0 C--N 1.333 0.396 0 CA-C-N 116.013 -0.539 . . . . 0.0 114.224 179.136 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.804 HD11 ' CB ' ' A' ' 23' ' ' ALA . 0.2 OUTLIER -141.83 -171.74 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.246 0 CA-C-O 120.734 0.302 . . . . 0.0 110.785 178.745 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.536 ' H ' HG22 ' A' ' 25' ' ' ILE . . . -44.57 97.64 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.676 -179.477 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.489 ' O ' ' N ' ' A' ' 30' ' ' ILE . 10.5 pt-20 -45.85 -25.23 0.49 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.16 179.187 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -41.29 -47.61 3.47 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 121.45 0.643 . . . . 0.0 110.8 179.456 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.594 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 63.3 m-85 -59.3 -32.39 70.01 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.336 179.909 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.956 HG13 HD22 ' A' ' 20' ' ' LEU . 25.8 mt -62.21 -26.64 40.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.464 177.969 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 6.3 tttm -74.29 -36.1 63.75 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.61 179.662 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.594 ' HG ' ' O ' ' A' ' 29' ' ' TYR . 0.1 OUTLIER -61.51 -33.97 74.71 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 120.216 -0.594 . . . . 0.0 109.815 179.353 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.552 HG22 ' HA ' ' A' ' 42' ' ' VAL . 2.4 pt -91.91 -44.71 14.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.046 179.408 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.421 ' CB ' ' O ' ' A' ' 30' ' ' ILE . . . -61.1 -30.99 70.69 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.079 -179.651 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 23.6 t30 -81.57 -3.05 52.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.114 -179.858 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.78 ' CB ' HD21 ' A' ' 9' ' ' LEU . . . 49.92 -131.04 1.95 Allowed 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 116.549 -0.296 . . . . 0.0 111.242 179.465 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.416 ' HB2' ' O ' ' A' ' 36' ' ' ALA . 0.0 OUTLIER 76.16 -5.65 2.14 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 179.937 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.714 ' O ' HG23 ' A' ' 42' ' ' VAL . 0.6 OUTLIER -159.9 71.41 0.47 Allowed 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 110.287 -0.264 . . . . 0.0 110.287 179.684 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.773 HG21 ' HB3' ' A' ' 7' ' ' LEU . 11.9 p -38.69 -50.63 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.906 -179.564 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.542 ' N ' HG13 ' A' ' 39' ' ' VAL . 2.1 mm-40 -61.05 -43.28 99.12 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 109.954 -0.388 . . . . 0.0 109.954 179.321 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.43 ' O ' ' HG ' ' A' ' 45' ' ' LEU . . . -66.9 -45.69 81.07 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.474 -0.869 . . . . 0.0 111.902 178.846 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 1.057 HG21 HD23 ' A' ' 9' ' ' LEU . 15.5 t -45.94 -39.36 3.17 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.111 0 CA-C-O 121.208 0.528 . . . . 0.0 110.352 179.141 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 45.9 t-105 -78.3 -32.06 49.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.586 179.004 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.408 ' HA ' ' OD2' ' A' ' 47' ' ' ASP . 1.3 m -77.74 -50.99 11.26 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.982 179.89 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.77 ' O ' HG22 ' A' ' 49' ' ' ILE . 0.9 OUTLIER -56.9 -34.51 67.98 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.314 179.543 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.464 ' CD ' ' HB2' ' A' ' 16' ' ' ALA . 11.3 ttpp -67.52 -58.42 4.74 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.633 179.877 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.408 ' OD2' ' HA ' ' A' ' 44' ' ' THR . 4.7 p30 -62.64 -27.43 69.21 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.362 -179.928 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -79.98 -51.29 9.25 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.74 179.64 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.77 HG22 ' O ' ' A' ' 45' ' ' LEU . 3.8 tp -57.49 -24.24 21.5 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 C-N-CA 120.741 -0.383 . . . . 0.0 110.917 179.997 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.611 HD13 ' HB3' ' A' ' 19' ' ' GLU . 2.3 tp -82.05 -35.15 29.06 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 178.89 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 10.8 m -65.22 -14.52 60.86 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 115.602 -0.726 . . . . 0.0 111.677 179.49 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.564 ' CG ' ' O ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -91.2 30.81 1.19 Allowed 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 121.288 0.566 . . . . 0.0 111.551 -179.498 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.644 ' O ' HG22 ' A' ' 53' ' ' THR . 7.5 m -174.83 70.77 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.46 179.147 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.436 HG22 ' N ' ' A' ' 55' ' ' THR . 9.1 p -157.56 156.48 4.21 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.526 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.628 -179.762 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.436 ' N ' HG22 ' A' ' 54' ' ' VAL . 0.2 OUTLIER -59.48 -68.29 0.29 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.915 -179.809 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.395 -0.812 . . . . 0.0 110.803 -179.864 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' THR . . . . . 0.595 ' O ' HG23 ' A' ' 2' ' ' THR . 4.1 p . . . . . 0 N--CA 1.486 1.34 0 CA-C-O 120.656 0.265 . . . . 0.0 111.468 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.595 HG23 ' O ' ' A' ' 1' ' ' THR . 4.5 p -161.96 131.33 4.51 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.06 0.457 . . . . 0.0 110.744 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' TYR . . . . . 0.589 ' CD1' HD21 ' A' ' 5' ' ' LEU . 1.1 t80 -81.22 -9.33 59.8 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.195 179.878 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.536 ' HG3' ' C ' ' A' ' 3' ' ' TYR . 0.0 OUTLIER 33.49 75.07 0.05 Allowed 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 179.798 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.589 HD21 ' CD1' ' A' ' 3' ' ' TYR . 0.7 OUTLIER -109.69 -65.7 1.13 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.195 0.521 . . . . 0.0 110.676 179.368 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.422 HG22 ' O ' ' A' ' 6' ' ' ILE . 19.1 mt 70.05 52.58 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.181 179.836 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.484 HD23 ' HB3' ' A' ' 5' ' ' LEU . 3.2 pp -128.83 1.82 5.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.78 179.763 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 8.1 p-10 -156.6 36.17 0.31 Allowed 'General case' 0 C--O 1.232 0.14 0 CA-C-O 120.799 0.333 . . . . 0.0 111.122 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.713 HD21 ' CB ' ' A' ' 36' ' ' ALA . 6.8 tt -85.36 -48.19 9.28 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.12 -179.742 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.494 ' HA ' ' HD3' ' A' ' 13' ' ' LYS . 3.7 tttt -52.56 -31.54 36.46 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.628 179.904 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 13.7 tt0 -87.61 -37.73 16.55 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.565 179.849 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -55.86 -38.18 69.77 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.519 179.473 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.652 ' HB3' HG11 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -85.05 -35.31 21.96 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.6 179.692 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.776 ' O ' HG22 ' A' ' 17' ' ' ILE . 2.3 mm-40 -58.09 -50.04 74.85 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 178.707 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -65.13 -31.05 72.05 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 177.84 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.696 ' HB1' ' CD1' ' A' ' 33' ' ' ILE . . . -68.22 -43.45 77.94 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 115.215 -0.902 . . . . 0.0 111.663 -179.838 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.776 HG22 ' O ' ' A' ' 14' ' ' GLU . 8.4 tp -60.31 -35.5 62.78 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.265 0 C-N-CA 120.645 -0.422 . . . . 0.0 109.875 179.933 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.84 -32.21 65.31 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 177.887 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.696 ' CG ' HD13 ' A' ' 50' ' ' LEU . 0.3 OUTLIER -62.2 -52.7 62.73 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.176 -0.92 . . . . 0.0 111.753 -179.797 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.803 HD22 HG13 ' A' ' 30' ' ' ILE . 0.2 OUTLIER -76.82 -34.45 57.9 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.878 -0.329 . . . . 0.0 110.99 -179.612 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.611 HG23 ' O ' ' A' ' 17' ' ' ILE . 24.1 t -61.55 -31.13 49.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 120.885 0.374 . . . . 0.0 110.199 179.386 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -90.3 -36.61 14.59 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.31 179.306 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -78.16 -14.95 59.26 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.19 179.603 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.423 ' N ' ' O ' ' A' ' 20' ' ' LEU . . . 50.47 105.3 0.01 OUTLIER Glycine 0 CA--C 1.522 0.504 0 C-N-CA 121.252 -0.499 . . . . 0.0 113.291 179.491 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.538 HG21 ' CE1' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -174.76 -171.94 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.377 0 CA-C-N 117.185 0.492 . . . . 0.0 111.678 179.397 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -40.85 95.94 0.01 OUTLIER 'General case' 0 C--O 1.232 0.14 0 CA-C-N 115.911 -0.586 . . . . 0.0 112.213 -179.186 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.428 ' O ' ' N ' ' A' ' 30' ' ' ILE . 21.3 mt-10 -53.0 -25.63 12.71 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.544 179.122 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.7 tptm -46.06 -45.54 16.19 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.388 179.152 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.783 ' CG ' HD13 ' A' ' 49' ' ' ILE . 2.8 m-85 -61.37 -30.52 70.59 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.041 179.585 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.803 HG13 HD22 ' A' ' 20' ' ' LEU . 40.9 mt -62.24 -26.67 40.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 177.991 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.407 ' O ' ' HB3' ' A' ' 35' ' ' ASN . 2.8 tttp -74.12 -37.13 64.19 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.629 179.386 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.587 ' HG ' ' O ' ' A' ' 29' ' ' TYR . 0.1 OUTLIER -62.38 -32.74 73.59 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 120.191 -0.604 . . . . 0.0 109.962 179.527 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.696 ' CD1' ' HB1' ' A' ' 16' ' ' ALA . 4.0 pt -91.85 -46.3 14.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.105 179.517 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.405 ' CB ' ' O ' ' A' ' 30' ' ' ILE . . . -60.64 -30.53 69.93 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.906 -179.576 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.407 ' HB3' ' O ' ' A' ' 31' ' ' LYS . 34.1 t30 -83.48 -14.05 53.28 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.83 179.868 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.713 ' CB ' HD21 ' A' ' 9' ' ' LEU . . . 57.61 -138.74 0.88 Allowed 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.124 179.429 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.484 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 0.0 OUTLIER 89.07 -21.5 0.14 Allowed 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 122.582 0.353 . . . . 0.0 111.131 -179.54 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.727 ' O ' HG23 ' A' ' 42' ' ' VAL . 1.5 m -143.22 78.57 1.61 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.49 179.579 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.514 HG13 ' N ' ' A' ' 40' ' ' GLU . 7.8 p -40.51 -49.07 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.396 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.714 -179.642 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.514 ' N ' HG13 ' A' ' 39' ' ' VAL . 2.5 mt-10 -60.68 -43.22 97.97 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 179.421 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.421 ' O ' ' HG ' ' A' ' 45' ' ' LEU . . . -67.5 -47.88 60.21 Favored Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.55 -0.833 . . . . 0.0 111.935 179.073 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.727 HG23 ' O ' ' A' ' 38' ' ' THR . 8.8 t -43.58 -41.47 1.47 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.226 0 CA-C-O 121.188 0.518 . . . . 0.0 110.366 179.213 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 2.4 t-105 -78.38 -32.07 48.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.178 179.391 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.8 m -79.28 -48.85 13.41 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 120.782 0.325 . . . . 0.0 110.993 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.69 ' O ' HG22 ' A' ' 49' ' ' ILE . 1.8 mt -56.92 -36.87 70.71 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.056 179.569 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.572 ' HD3' ' HB2' ' A' ' 16' ' ' ALA . 7.4 ttpt -66.65 -60.2 2.92 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.486 179.309 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -57.71 -33.23 68.2 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.574 -179.916 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -76.35 -52.71 9.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.999 179.866 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.783 HD13 ' CG ' ' A' ' 29' ' ' TYR . 9.4 tp -59.43 -24.32 27.86 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.214 -179.83 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.696 HD13 ' CG ' ' A' ' 19' ' ' GLU . 3.2 tp -79.37 -34.34 42.09 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 178.741 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 23.0 m -59.04 -35.71 73.77 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.88 179.376 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.79 ' CG ' ' O ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -72.05 55.95 0.31 Allowed 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 121.447 0.642 . . . . 0.0 110.38 179.886 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.2 m 165.66 -62.87 0.0 OUTLIER 'General case' 0 N--CA 1.46 0.033 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 -179.885 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 2.9 t -93.28 85.4 1.99 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.963 179.434 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -58.22 126.33 27.04 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 120.912 0.387 . . . . 0.0 110.671 -179.65 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.252 1.212 0 CA-C-O 118.387 -0.816 . . . . 0.0 110.993 179.737 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 3.0 m . . . . . 0 N--CA 1.48 1.038 0 CA-C-O 120.496 0.188 . . . . 0.0 111.432 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.552 ' OG1' HD11 ' A' ' 5' ' ' LEU . 19.2 p -86.32 142.82 28.23 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.319 179.757 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 30.9 p90 -113.8 32.51 5.79 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.98 -179.929 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.486 ' C ' HD12 ' A' ' 5' ' ' LEU . 0.0 OUTLIER -155.18 105.35 2.51 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.907 0.384 . . . . 0.0 110.749 -179.722 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.552 HD11 ' OG1' ' A' ' 2' ' ' THR . 4.9 mp -153.04 101.16 2.55 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.954 179.9 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 1.8 tt -46.52 -29.1 1.04 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.84 179.917 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 26.4 tp -132.36 144.96 50.9 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.538 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ASN . . . . . 0.578 ' O ' ' HB2' ' A' ' 12' ' ' ALA . 0.2 OUTLIER -158.9 41.06 0.23 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.053 -179.725 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 1.05 HD23 HG21 ' A' ' 42' ' ' VAL . 0.2 OUTLIER -82.52 -48.86 10.53 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.98 0.419 . . . . 0.0 110.518 179.841 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.685 ' N ' HD13 ' A' ' 9' ' ' LEU . 35.7 mttt -59.38 -33.72 71.54 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.832 179.868 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.43 ' O ' ' HG2' ' A' ' 14' ' ' GLU . 2.3 mp0 -88.15 -36.55 16.78 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.056 -179.86 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.578 ' HB2' ' O ' ' A' ' 8' ' ' ASN . . . -57.41 -37.23 72.42 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.84 0.352 . . . . 0.0 110.334 179.511 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.57 ' HB3' HG11 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -84.92 -37.38 20.61 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.773 179.678 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.477 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 4.1 pt-20 -56.56 -49.37 75.03 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 109.141 -0.688 . . . . 0.0 109.141 178.875 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.441 ' N ' ' CG ' ' A' ' 14' ' ' GLU . 0.8 OUTLIER -65.01 -31.54 72.83 Favored 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 108.774 -0.824 . . . . 0.0 108.774 177.738 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.703 ' HB1' ' CD1' ' A' ' 33' ' ' ILE . . . -65.09 -43.38 92.31 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.59 179.267 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.71 ' O ' HG23 ' A' ' 21' ' ' VAL . 37.1 mm -55.83 -48.26 78.5 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.207 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 178.771 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.6 pttt -60.98 -32.38 71.94 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.562 178.37 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.555 ' CG ' HD13 ' A' ' 50' ' ' LEU . 0.2 OUTLIER -65.76 -52.35 51.71 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.701 179.496 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.742 HD22 ' HB ' ' A' ' 30' ' ' ILE . 0.2 OUTLIER -73.55 -33.94 64.95 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.685 179.965 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.71 HG23 ' O ' ' A' ' 17' ' ' ILE . 54.4 t -64.64 -31.26 52.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 120.92 0.391 . . . . 0.0 110.169 179.219 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -88.77 -34.59 17.06 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.283 179.478 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.85 ' HB3' HD11 ' A' ' 25' ' ' ILE . . . -81.1 -15.22 56.55 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.313 179.505 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 41.73 82.67 0.02 OUTLIER Glycine 0 C--N 1.334 0.433 0 CA-C-N 116.216 -0.447 . . . . 0.0 113.846 179.362 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.85 HD11 ' HB3' ' A' ' 23' ' ' ALA . 0.1 OUTLIER -146.38 -163.3 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.219 0 CA-C-N 116.709 0.254 . . . . 0.0 110.909 179.397 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -43.89 95.3 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 120.782 0.325 . . . . 0.0 111.85 -179.447 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.626 ' O ' HG22 ' A' ' 30' ' ' ILE . 0.3 OUTLIER -52.18 -26.28 11.17 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.952 0.406 . . . . 0.0 110.561 179.415 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.5 tptm -46.69 -45.7 19.62 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-O 121.277 0.561 . . . . 0.0 110.319 179.135 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.788 ' CG ' HD13 ' A' ' 49' ' ' ILE . 3.6 m-85 -62.72 -31.01 71.85 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.878 179.558 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.742 ' HB ' HD22 ' A' ' 20' ' ' LEU . 1.6 tt -61.56 -26.51 39.8 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.627 178.322 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.03 -37.45 58.35 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.735 179.634 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.591 ' HG ' ' HA ' ' A' ' 29' ' ' TYR . 0.1 OUTLIER -60.52 -32.76 71.78 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 120.123 -0.631 . . . . 0.0 109.966 179.415 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.703 ' CD1' ' HB1' ' A' ' 16' ' ' ALA . 3.7 pt -91.76 -47.22 14.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.923 179.442 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.41 ' HB2' HD11 ' A' ' 17' ' ' ILE . . . -59.05 -29.23 67.15 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.999 -179.558 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 -85.72 -11.35 53.88 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.26 -179.763 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.632 ' CB ' HD21 ' A' ' 9' ' ' LEU . . . 56.88 -141.2 0.81 Allowed 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 116.774 -0.194 . . . . 0.0 111.065 179.615 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.484 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 0.0 OUTLIER 89.45 -21.33 0.14 Allowed 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 122.629 0.372 . . . . 0.0 111.34 179.978 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.892 ' O ' HG23 ' A' ' 42' ' ' VAL . 9.9 m -144.05 77.72 1.56 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.676 0.274 . . . . 0.0 110.55 179.791 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.529 HG13 ' N ' ' A' ' 40' ' ' GLU . 14.5 p -38.85 -48.44 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.405 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.703 -179.878 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.529 ' N ' HG13 ' A' ' 39' ' ' VAL . 1.8 tt0 -61.39 -52.86 62.84 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.153 179.569 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.753 ' H ' HG22 ' A' ' 38' ' ' THR . . . -61.79 -38.47 96.01 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.323 -0.942 . . . . 0.0 112.158 179.188 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 1.05 HG21 HD23 ' A' ' 9' ' ' LEU . 22.8 t -49.24 -45.32 17.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.938 0.399 . . . . 0.0 110.503 179.372 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.486 ' CZ2' ' HA ' ' A' ' 40' ' ' GLU . 1.1 p90 -79.04 -25.66 43.18 Favored 'General case' 0 N--CA 1.457 -0.121 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.028 179.308 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.422 ' N ' ' CD1' ' A' ' 43' ' ' TRP . 1.3 m -79.3 -47.53 15.7 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-O 120.885 0.374 . . . . 0.0 110.862 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.69 ' O ' HG22 ' A' ' 49' ' ' ILE . 4.4 mm? -61.19 -33.54 73.62 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.01 179.527 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.566 ' HD3' ' HB2' ' A' ' 16' ' ' ALA . 17.5 ttpt -67.85 -59.6 3.17 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.395 179.422 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.52 -32.56 70.41 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.291 179.888 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -76.35 -51.95 10.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.97 179.84 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.788 HD13 ' CG ' ' A' ' 29' ' ' TYR . 8.6 tp -59.85 -23.86 27.79 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.243 0 C-N-CA 120.691 -0.403 . . . . 0.0 111.353 -179.804 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.555 HD13 ' CG ' ' A' ' 19' ' ' GLU . 3.2 tp -79.77 -34.62 39.63 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 178.802 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.461 ' HA ' ' CG2' ' A' ' 54' ' ' VAL . 9.3 m -67.21 -17.08 64.67 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.569 -0.741 . . . . 0.0 111.826 179.514 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.65 ' CE1' HG21 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -87.85 33.1 0.72 Allowed 'General case' 0 N--CA 1.462 0.162 0 CA-C-O 121.502 0.667 . . . . 0.0 111.074 179.964 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.48 ' O ' ' N ' ' A' ' 55' ' ' THR . 2.8 m 178.32 -70.65 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.137 -0.938 . . . . 0.0 108.894 179.599 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.498 HG23 ' O ' ' A' ' 50' ' ' LEU . 72.5 t 60.46 -69.93 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.462 0 CA-C-N 115.478 -0.783 . . . . 0.0 111.649 178.966 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.48 ' N ' ' O ' ' A' ' 53' ' ' THR . 86.3 m -127.5 -81.42 0.6 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.829 0.347 . . . . 0.0 110.82 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 . . . . . 0 C--O 1.247 0.946 0 CA-C-O 118.23 -0.891 . . . . 0.0 110.839 -179.828 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 35.3 p . . . . . 0 N--CA 1.488 1.431 0 CA-C-O 121.436 0.636 . . . . 0.0 111.046 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 40.0 p -115.87 -54.94 2.47 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.76 -179.766 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 58.17 22.0 8.64 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.086 179.908 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -165.46 83.77 0.35 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.171 0.51 . . . . 0.0 110.813 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.4 mt -119.49 169.5 9.99 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.837 -179.891 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.427 ' HB ' HD12 ' A' ' 7' ' ' LEU . 20.2 mt -76.89 -31.93 19.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 121.286 0.565 . . . . 0.0 111.246 179.938 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.657 ' HB3' HG21 ' A' ' 39' ' ' VAL . 3.7 mp -145.94 -41.86 0.21 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.192 -179.868 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ASN . . . . . 0.559 ' CB ' ' O ' ' A' ' 7' ' ' LEU . 5.8 t-20 98.58 -0.53 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.502 0 O-C-N 123.643 0.589 . . . . 0.0 110.726 -179.58 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.735 HD21 ' HB2' ' A' ' 36' ' ' ALA . 7.4 tt -49.65 -47.72 49.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.275 179.511 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.489 ' HA ' ' HD3' ' A' ' 13' ' ' LYS . 0.8 OUTLIER -51.82 -32.6 32.31 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.745 179.962 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -89.89 -29.14 18.75 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.879 179.939 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.97 -37.44 87.41 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.106 179.347 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.645 ' HB3' HG11 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -85.27 -35.39 21.56 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.862 179.66 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.72 ' O ' HG22 ' A' ' 17' ' ' ILE . 0.1 OUTLIER -61.21 -47.34 86.54 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 179.218 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -65.76 -34.19 77.61 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 177.913 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.523 ' HB1' ' CD1' ' A' ' 33' ' ' ILE . . . -68.33 -36.83 79.85 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.5 179.39 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.72 HG22 ' O ' ' A' ' 14' ' ' GLU . 1.1 tp -58.19 -35.89 55.09 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.249 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 179.286 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 19.8 mttt -75.11 -33.07 61.56 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.654 178.347 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.618 ' HB3' HD13 ' A' ' 50' ' ' LEU . 0.4 OUTLIER -62.2 -52.32 64.26 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.659 179.407 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.79 HD22 ' HB ' ' A' ' 30' ' ' ILE . 0.3 OUTLIER -69.93 -34.79 73.93 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.685 179.946 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.712 HG23 ' O ' ' A' ' 17' ' ' ILE . 37.7 t -64.78 -31.29 53.18 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.229 0 CA-C-O 120.937 0.399 . . . . 0.0 109.933 179.091 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -84.21 -38.09 21.01 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.031 179.15 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.748 ' HB3' HD11 ' A' ' 25' ' ' ILE . . . -76.79 -15.3 59.78 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.141 179.333 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.401 ' C ' HG13 ' A' ' 25' ' ' ILE . . . 41.18 90.07 0.01 OUTLIER Glycine 0 C--N 1.335 0.495 0 CA-C-N 116.211 -0.449 . . . . 0.0 113.856 179.258 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.748 HD11 ' HB3' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -155.51 -164.71 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.271 0 CA-C-O 120.713 0.292 . . . . 0.0 110.922 179.179 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.559 ' HB3' ' CD2' ' A' ' 29' ' ' TYR . . . -44.75 95.76 0.01 OUTLIER 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.844 -179.586 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.651 ' O ' HG22 ' A' ' 30' ' ' ILE . 53.2 mt-10 -48.42 -26.96 2.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.674 179.432 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 12.2 tptm -44.96 -45.45 10.53 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.504 179.274 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.615 ' HA ' ' HG ' ' A' ' 32' ' ' LEU . 75.8 m-85 -61.05 -32.52 72.15 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.422 0.629 . . . . 0.0 110.128 179.614 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.79 ' HB ' HD22 ' A' ' 20' ' ' LEU . 2.2 tt -61.9 -26.38 39.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.705 178.484 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.9 tppp? -75.68 -35.6 60.31 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.576 179.472 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.893 ' HB2' HD23 ' A' ' 45' ' ' LEU . 0.2 OUTLIER -59.77 -35.18 74.1 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 120.361 -0.536 . . . . 0.0 109.749 179.316 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.523 ' CD1' ' HB1' ' A' ' 16' ' ' ALA . 2.9 pt -90.76 -46.33 14.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.945 179.402 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -60.51 -28.82 68.68 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.086 -179.704 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 -84.41 -12.93 53.52 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.406 -179.7 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.735 ' HB2' HD21 ' A' ' 9' ' ' LEU . . . 62.7 -136.17 0.44 Allowed 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 116.86 -0.155 . . . . 0.0 110.84 179.61 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.489 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 0.0 OUTLIER 87.64 -14.86 0.42 Allowed 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 179.808 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.654 ' O ' HG23 ' A' ' 42' ' ' VAL . 5.5 t -158.82 79.17 0.78 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.868 0.366 . . . . 0.0 110.635 179.388 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.697 ' CA ' HD12 ' A' ' 9' ' ' LEU . 10.2 p -38.65 -49.97 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.483 0 CA-C-N 115.894 -0.593 . . . . 0.0 111.753 -179.794 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.548 ' N ' HG13 ' A' ' 39' ' ' VAL . 2.8 mt-10 -60.19 -43.09 96.19 Favored 'General case' 0 CA--C 1.52 -0.194 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 179.365 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.407 ' N ' ' O ' ' A' ' 38' ' ' THR . . . -67.66 -46.7 66.54 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.448 -0.882 . . . . 0.0 111.921 178.752 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.654 HG23 ' O ' ' A' ' 38' ' ' THR . 12.2 t -43.97 -40.99 1.65 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.197 0 CA-C-O 121.062 0.458 . . . . 0.0 110.399 179.339 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 4.6 t-105 -78.64 -32.26 47.27 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.163 179.39 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.6 m -79.14 -45.12 20.63 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.887 0.375 . . . . 0.0 110.913 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.893 HD23 ' HB2' ' A' ' 32' ' ' LEU . 0.4 OUTLIER -60.06 -34.98 74.16 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.894 179.546 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.452 ' HA ' HG22 ' A' ' 49' ' ' ILE . 9.7 ttpt -68.05 -61.04 2.04 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.366 179.409 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -57.03 -32.71 66.45 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.365 179.801 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -76.46 -52.82 9.09 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.811 179.772 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.727 HG22 ' O ' ' A' ' 45' ' ' LEU . 6.2 tp -59.39 -23.86 26.45 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.32 0 C-N-CA 120.759 -0.376 . . . . 0.0 111.179 -179.895 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.618 HD13 ' HB3' ' A' ' 19' ' ' GLU . 5.4 tp -79.57 -32.54 42.04 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.19 0.519 . . . . 0.0 109.613 178.856 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 16.3 m -68.31 -20.69 64.76 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.602 -0.726 . . . . 0.0 112.049 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.614 ' CG ' ' O ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -85.11 43.78 1.03 Allowed 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 121.635 0.731 . . . . 0.0 111.185 -179.74 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 5.7 m -176.18 -67.42 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.516 179.331 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 3.3 t -78.05 -71.28 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.607 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.544 179.875 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.06 101.57 0.22 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.983 0.421 . . . . 0.0 111.088 -179.759 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 . . . . . 0 C--O 1.246 0.892 0 CA-C-O 118.266 -0.874 . . . . 0.0 110.933 -179.961 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 3.0 m . . . . . 0 N--CA 1.486 1.36 0 CA-C-O 120.944 0.402 . . . . 0.0 111.188 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.471 HG21 HD21 ' A' ' 5' ' ' LEU . 34.9 p -126.89 -56.01 1.37 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.71 -179.927 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 1.2 t80 58.86 21.05 8.66 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.638 -179.449 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 5.1 ttpt -163.27 81.83 0.47 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.078 -179.86 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.471 HD21 HG21 ' A' ' 2' ' ' THR . 4.1 mt -129.93 -56.56 1.12 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.584 -179.704 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.614 HG23 ' HG3' ' A' ' 10' ' ' LYS . 20.1 mt -128.17 91.91 1.79 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.377 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.905 -179.956 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 4.0 tp -176.09 -38.08 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 120.618 0.247 . . . . 0.0 111.219 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ASN . . . . . 0.779 ' ND2' HG21 ' A' ' 39' ' ' VAL . 5.8 p-10 -107.73 -53.05 2.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.88 0.371 . . . . 0.0 110.871 -179.86 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.951 ' CD1' HG21 ' A' ' 42' ' ' VAL . 1.3 tp -69.01 -48.99 61.67 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.815 179.85 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.614 ' HG3' HG23 ' A' ' 6' ' ' ILE . 0.7 OUTLIER -59.39 -34.61 72.65 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.864 -179.938 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -88.5 -30.91 19.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.782 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.472 ' HB2' ' O ' ' A' ' 8' ' ' ASN . . . -61.05 -37.75 83.75 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.085 179.321 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.613 ' HB3' HG11 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -85.03 -37.03 20.85 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.752 179.626 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.47 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 0.3 OUTLIER -58.45 -47.28 84.53 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 179.229 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -66.39 -33.11 74.97 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 177.837 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.609 ' HB1' ' CD1' ' A' ' 33' ' ' ILE . . . -64.0 -36.93 85.59 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.394 179.268 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.768 ' O ' HG23 ' A' ' 21' ' ' VAL . 4.9 mm -60.94 -50.95 78.45 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.337 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 178.697 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.29 -32.2 66.39 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.355 -0.839 . . . . 0.0 109.851 178.498 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.602 ' CG ' HD13 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -61.88 -52.47 63.99 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.081 179.694 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.863 HD22 HG13 ' A' ' 30' ' ' ILE . 0.2 OUTLIER -79.39 -29.58 42.13 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.756 -179.984 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.768 HG23 ' O ' ' A' ' 17' ' ' ILE . 65.0 t -64.91 -32.43 58.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.274 179.571 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -90.0 -38.11 13.85 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.035 179.232 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -76.24 -14.72 60.12 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.023 179.283 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 48.25 97.67 0.01 OUTLIER Glycine 0 C--N 1.332 0.344 0 C-N-CA 121.143 -0.551 . . . . 0.0 113.002 179.58 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.658 HG21 ' CE1' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -160.11 -166.64 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.26 0 CA-C-N 116.899 0.35 . . . . 0.0 111.125 179.734 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -47.76 94.56 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.85 -179.549 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.414 ' O ' ' N ' ' A' ' 30' ' ' ILE . 4.2 mm-40 -51.24 -26.9 7.85 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.069 0.461 . . . . 0.0 110.48 179.267 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -46.8 -44.81 19.53 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.065 178.926 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.757 ' CG ' HD13 ' A' ' 49' ' ' ILE . 3.5 m-85 -60.76 -31.72 71.06 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.067 179.5 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.863 HG13 HD22 ' A' ' 20' ' ' LEU . 43.2 mt -61.57 -26.53 39.85 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 CA-C-N 115.967 -0.56 . . . . 0.0 109.507 178.02 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.3 tttp -74.45 -35.92 63.35 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.477 179.399 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.902 ' HB2' HD23 ' A' ' 45' ' ' LEU . 0.2 OUTLIER -61.36 -33.83 74.3 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 120.377 -0.529 . . . . 0.0 109.93 179.464 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.609 ' CD1' ' HB1' ' A' ' 16' ' ' ALA . 2.3 pt -91.83 -46.65 14.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.831 179.506 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.402 ' CB ' ' O ' ' A' ' 30' ' ' ILE . . . -58.85 -29.56 67.03 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.889 -179.659 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 24.0 t30 -85.13 -7.07 59.24 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.218 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.798 ' HB1' HD21 ' A' ' 9' ' ' LEU . . . 51.62 -138.74 1.04 Allowed 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 116.704 -0.225 . . . . 0.0 111.248 179.401 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.51 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 0.0 OUTLIER 93.1 -24.66 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 122.749 0.419 . . . . 0.0 111.072 -179.886 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.699 ' O ' HG23 ' A' ' 42' ' ' VAL . 1.9 p -145.88 81.14 1.6 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.576 179.794 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.779 HG21 ' ND2' ' A' ' 8' ' ' ASN . 13.6 p -41.79 -47.59 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.36 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.691 -179.863 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.518 ' N ' HG13 ' A' ' 39' ' ' VAL . 1.8 mt-10 -60.56 -41.83 95.37 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 179.461 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -72.21 -42.22 51.09 Favored Glycine 0 C--O 1.223 -0.589 0 C-N-CA 120.332 -0.937 . . . . 0.0 112.229 178.968 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.951 HG21 ' CD1' ' A' ' 9' ' ' LEU . 25.3 t -45.78 -44.75 4.75 Favored 'Isoleucine or valine' 0 C--O 1.232 0.182 0 CA-C-N 116.978 0.389 . . . . 0.0 110.927 179.583 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.475 ' CD1' ' HA ' ' A' ' 40' ' ' GLU . 13.1 p-90 -79.23 -28.84 42.51 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.177 179.669 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.7 m -79.73 -36.73 36.93 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 120.487 -0.485 . . . . 0.0 110.948 179.856 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.902 HD23 ' HB2' ' A' ' 32' ' ' LEU . 1.0 OUTLIER -68.14 -32.52 72.85 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.147 -0.479 . . . . 0.0 109.79 179.375 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.512 ' HD3' ' HB2' ' A' ' 16' ' ' ALA . 8.2 ttpt -69.81 -61.53 1.74 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.273 179.263 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -57.3 -27.71 62.4 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.103 179.579 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -79.91 -53.58 6.63 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.733 179.715 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.757 HD13 ' CG ' ' A' ' 29' ' ' TYR . 6.3 tp -58.33 -24.45 24.72 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.129 0 C-N-CA 120.729 -0.388 . . . . 0.0 111.027 -179.954 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.602 HD13 ' CG ' ' A' ' 19' ' ' GLU . 1.0 OUTLIER -80.91 -34.66 33.28 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 178.812 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 8.5 m -65.75 -15.69 63.08 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.699 179.483 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.658 ' CE1' HG21 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -88.98 36.8 0.82 Allowed 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 121.604 0.716 . . . . 0.0 111.241 -179.651 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.44 ' O ' HG12 ' A' ' 54' ' ' VAL . 2.9 m -177.88 -69.96 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.705 179.242 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.44 HG12 ' O ' ' A' ' 53' ' ' THR . 0.4 OUTLIER 70.2 150.91 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.103 179.382 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 3.9 m -134.6 55.77 1.88 Allowed 'General case' 0 CA--C 1.52 -0.208 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.851 179.616 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 . . . . . 0 C--O 1.252 1.217 0 CA-C-O 118.041 -0.981 . . . . 0.0 110.986 179.924 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' THR . . . . . 0.772 ' HA ' HD11 ' A' ' 5' ' ' LEU . 1.4 p . . . . . 0 N--CA 1.495 1.791 0 CA-C-O 120.785 0.326 . . . . 0.0 111.123 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -106.41 93.84 4.82 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.671 -179.696 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 41.54 32.63 0.24 Allowed 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.225 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 3.3 ttpt -148.61 78.41 1.41 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.573 -179.881 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.772 HD11 ' HA ' ' A' ' 1' ' ' THR . 7.6 mt -145.9 68.5 1.2 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.799 179.508 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 1.8 tt -178.29 141.64 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.176 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -167.27 137.54 2.95 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.25 0.548 . . . . 0.0 110.485 -179.984 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 168.31 -42.0 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.276 179.699 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.969 ' CD1' HG21 ' A' ' 42' ' ' VAL . 4.1 tp -57.85 -49.02 78.08 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.923 0.392 . . . . 0.0 111.296 -179.718 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.414 ' HA ' ' HD3' ' A' ' 13' ' ' LYS . 3.2 mtpt -57.46 -36.76 71.85 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.298 -179.636 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -85.12 -39.14 18.25 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.073 -179.798 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.74 -38.04 66.66 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.622 179.684 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.747 ' HB3' HG11 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -85.03 -35.66 21.76 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.756 179.608 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.459 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 3.1 mm-40 -60.05 -50.52 73.4 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 179.075 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 68.8 tt0 -64.83 -31.81 73.22 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 178.038 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.577 ' CB ' HD12 ' A' ' 33' ' ' ILE . . . -65.0 -37.78 88.78 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.175 179.194 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.802 ' O ' HG23 ' A' ' 21' ' ' VAL . 20.6 mm -58.03 -46.31 87.98 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.169 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 178.398 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.69 -32.22 73.26 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.272 -0.877 . . . . 0.0 109.47 178.237 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.519 ' CB ' HD13 ' A' ' 50' ' ' LEU . 0.4 OUTLIER -63.64 -52.42 60.87 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.565 179.268 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.803 HD22 ' HB ' ' A' ' 30' ' ' ILE . 0.3 OUTLIER -70.9 -33.98 71.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.66 179.88 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.802 HG23 ' O ' ' A' ' 17' ' ' ILE . 78.1 t -63.9 -31.17 52.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.908 0.385 . . . . 0.0 110.07 179.103 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -87.08 -37.89 17.0 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.244 179.371 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.515 ' HB3' HD11 ' A' ' 25' ' ' ILE . . . -77.57 -15.39 59.27 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.211 179.63 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 40.19 90.27 0.01 OUTLIER Glycine 0 C--N 1.335 0.482 0 CA-C-N 116.279 -0.419 . . . . 0.0 114.057 179.267 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.618 HD12 ' N ' ' A' ' 25' ' ' ILE . 0.2 OUTLIER -162.76 -167.71 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.227 0 CA-C-N 116.839 0.32 . . . . 0.0 111.138 179.06 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -33.66 95.89 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 112.398 0.518 . . . . 0.0 112.398 -179.169 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.457 ' O ' HG22 ' A' ' 30' ' ' ILE . 0.0 OUTLIER -56.21 -25.75 48.42 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.501 179.443 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.12 -46.1 11.65 Favored 'General case' 0 C--O 1.239 0.507 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.899 179.402 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.634 ' HA ' ' HG ' ' A' ' 32' ' ' LEU . 3.3 m-85 -64.37 -30.36 71.4 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.242 0.544 . . . . 0.0 110.242 179.848 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.803 ' HB ' HD22 ' A' ' 20' ' ' LEU . 0.9 OUTLIER -62.0 -26.39 39.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.415 178.175 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.7 ttmm -75.62 -37.83 59.43 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.55 179.484 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.634 ' HG ' ' HA ' ' A' ' 29' ' ' TYR . 0.1 OUTLIER -59.24 -33.74 71.38 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 120.102 -0.639 . . . . 0.0 109.783 179.43 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.63 HG22 ' HA ' ' A' ' 42' ' ' VAL . 4.9 pt -90.87 -48.33 14.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.807 179.272 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -56.2 -28.89 59.92 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.886 -179.864 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -88.62 -15.95 33.7 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.946 179.755 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.781 ' HB1' HD21 ' A' ' 9' ' ' LEU . . . 61.73 -137.7 0.51 Allowed 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.011 179.458 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.468 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 12.1 mttt 90.33 -22.86 0.1 Allowed 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 122.875 0.47 . . . . 0.0 111.23 -179.789 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.736 ' O ' HG23 ' A' ' 42' ' ' VAL . 0.7 OUTLIER -143.58 79.43 1.63 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.584 179.748 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.51 HG13 ' N ' ' A' ' 40' ' ' GLU . 13.5 p -40.15 -47.72 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.595 -179.93 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.51 ' N ' HG13 ' A' ' 39' ' ' VAL . 1.9 mt-10 -62.8 -43.95 97.45 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 179.427 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.471 ' O ' ' N ' ' A' ' 45' ' ' LEU . . . -66.49 -46.7 75.16 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.482 -0.866 . . . . 0.0 111.759 178.836 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.969 HG21 ' CD1' ' A' ' 9' ' ' LEU . 17.0 t -44.83 -41.48 2.23 Favored 'Isoleucine or valine' 0 C--O 1.234 0.248 0 CA-C-O 121.215 0.531 . . . . 0.0 110.27 179.109 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 31.7 t-105 -76.62 -31.51 57.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.957 179.098 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 m -80.53 -53.1 6.88 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.765 0.316 . . . . 0.0 110.986 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.708 ' O ' HG22 ' A' ' 49' ' ' ILE . 3.7 mm? -52.86 -35.73 57.95 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.035 0.445 . . . . 0.0 109.93 179.468 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.532 ' HG3' ' HA ' ' A' ' 16' ' ' ALA . 1.2 ttmt -68.05 -59.54 3.17 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.114 179.241 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -57.71 -31.47 66.43 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.234 179.768 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -77.16 -52.59 9.0 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.891 179.795 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.708 HG22 ' O ' ' A' ' 45' ' ' LEU . 7.1 tp -60.78 -23.88 30.57 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-O 120.792 0.329 . . . . 0.0 111.144 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.519 HD13 ' CB ' ' A' ' 19' ' ' GLU . 5.4 tp -79.33 -32.95 43.5 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 178.675 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 31.6 m -61.99 -36.63 82.06 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.2 179.519 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.782 ' CG ' ' O ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -71.63 58.25 0.3 Allowed 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 121.556 0.693 . . . . 0.0 110.635 -179.882 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 18.7 m -174.91 -70.45 0.01 OUTLIER 'General case' 0 C--O 1.232 0.132 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 179.653 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 2.6 t -76.51 105.96 5.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.474 179.149 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 60.65 -144.14 0.49 Allowed 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.156 179.816 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.241 -0.885 . . . . 0.0 110.899 -179.949 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 1.4 m . . . . . 0 N--CA 1.487 1.381 0 CA-C-O 120.7 0.286 . . . . 0.0 111.063 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.782 ' O ' HD21 ' A' ' 5' ' ' LEU . 0.0 OUTLIER -130.07 158.22 40.23 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.137 179.904 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 5.6 p90 -97.11 24.56 6.22 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.152 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.752 ' C ' HD13 ' A' ' 5' ' ' LEU . 0.0 OUTLIER -154.63 86.69 1.14 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.418 0.627 . . . . 0.0 111.041 179.687 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.782 HD21 ' O ' ' A' ' 2' ' ' THR . 0.0 OUTLIER -128.11 -38.3 1.82 Allowed 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.073 179.989 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.59 HG22 ' O ' ' A' ' 5' ' ' LEU . 0.1 OUTLIER 92.11 -31.13 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 C-N-CA 123.031 0.533 . . . . 0.0 110.876 -179.315 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.609 ' O ' HG21 ' A' ' 39' ' ' VAL . 1.1 mt 55.75 -89.5 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.37 179.279 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 73.62 32.56 1.15 Allowed 'General case' 0 C--N 1.334 -0.101 0 CA-C-O 121.454 0.645 . . . . 0.0 109.422 -178.84 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 1.069 HD23 HG21 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -73.46 -42.89 61.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.04 -0.982 . . . . 0.0 111.143 -179.266 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.896 ' N ' HD13 ' A' ' 9' ' ' LEU . 0.0 OUTLIER -51.96 -37.25 52.21 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.933 0.397 . . . . 0.0 111.234 -179.478 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.08 -30.31 19.99 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.142 -179.794 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.19 -37.1 85.9 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.261 179.579 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.494 ' HG2' ' N ' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -85.22 -37.69 19.81 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.948 179.701 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.494 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -56.46 -45.77 80.68 Favored 'General case' 0 C--O 1.233 0.234 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 179.068 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -68.27 -33.53 74.53 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.382 -0.826 . . . . 0.0 108.876 177.859 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.6 ' HB1' ' CD1' ' A' ' 33' ' ' ILE . . . -66.36 -37.41 85.24 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.317 179.54 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.773 ' O ' HG23 ' A' ' 21' ' ' VAL . 32.0 mm -58.81 -48.47 86.06 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.171 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 178.751 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.66 -32.86 73.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.691 178.5 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.602 ' CG ' HD13 ' A' ' 50' ' ' LEU . 0.3 OUTLIER -61.51 -52.41 64.61 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.549 -0.75 . . . . 0.0 111.06 179.861 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.575 HD22 ' HB ' ' A' ' 30' ' ' ILE . 0.2 OUTLIER -76.26 -34.91 59.15 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.951 -179.659 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.773 HG23 ' O ' ' A' ' 17' ' ' ILE . 71.3 t -63.42 -31.12 51.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 120.941 0.4 . . . . 0.0 110.374 179.528 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -91.49 -34.38 14.82 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.427 179.6 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -79.96 -15.17 57.82 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.323 179.791 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.791 ' O ' HG23 ' A' ' 25' ' ' ILE . . . 46.42 102.49 0.01 OUTLIER Glycine 0 CA--C 1.523 0.59 0 C-N-CA 121.315 -0.469 . . . . 0.0 113.334 179.476 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.802 HD12 ' CE1' ' A' ' 52' ' ' PHE . 1.1 pt -172.99 -173.4 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.21 0 CA-C-N 117.003 0.401 . . . . 0.0 111.326 179.501 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -36.84 95.14 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 -179.242 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.612 ' O ' HG22 ' A' ' 30' ' ' ILE . 1.6 pt-20 -54.14 -25.48 22.55 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.732 179.47 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -44.52 -47.49 10.14 Favored 'General case' 0 C--O 1.239 0.522 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.593 179.303 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.632 ' HA ' ' HG ' ' A' ' 32' ' ' LEU . 2.1 m-85 -63.81 -30.46 71.55 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.237 0.541 . . . . 0.0 110.06 179.655 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.612 HG22 ' O ' ' A' ' 27' ' ' GLU . 1.4 tt -60.81 -26.42 38.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.397 177.953 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.1 tptm -76.07 -37.55 58.11 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.593 179.515 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.725 ' HB2' HD13 ' A' ' 45' ' ' LEU . 0.1 OUTLIER -60.48 -32.42 71.41 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 119.885 -0.726 . . . . 0.0 109.856 179.349 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.6 ' CD1' ' HB1' ' A' ' 16' ' ' ALA . 4.6 pt -91.86 -48.34 13.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.851 179.456 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.652 ' HB2' HD11 ' A' ' 17' ' ' ILE . . . -58.54 -29.35 66.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.907 -179.687 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 7.8 t-20 -85.19 -17.96 35.55 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.936 179.768 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.533 ' CB ' HD21 ' A' ' 9' ' ' LEU . . . 61.28 -143.32 0.47 Allowed 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 116.626 -0.261 . . . . 0.0 110.923 179.612 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.497 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 0.0 OUTLIER 90.18 -21.79 0.12 Allowed 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 122.633 0.373 . . . . 0.0 111.406 -179.973 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.869 ' O ' HG23 ' A' ' 42' ' ' VAL . 0.6 OUTLIER -141.39 77.02 1.57 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.683 0.277 . . . . 0.0 110.639 179.878 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.609 HG21 ' O ' ' A' ' 7' ' ' LEU . 12.3 p -39.38 -47.04 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.63 -179.851 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.507 ' N ' HG13 ' A' ' 39' ' ' VAL . 0.4 OUTLIER -61.16 -52.69 63.76 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 179.563 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.454 ' O ' ' HG ' ' A' ' 45' ' ' LEU . . . -63.35 -37.55 95.02 Favored Glycine 0 C--O 1.226 -0.372 0 C-N-CA 120.246 -0.978 . . . . 0.0 112.186 179.234 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 1.069 HG21 HD23 ' A' ' 9' ' ' LEU . 29.1 t -49.9 -44.53 21.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 121.067 0.46 . . . . 0.0 110.387 179.416 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.499 ' CZ2' ' HA ' ' A' ' 40' ' ' GLU . 1.1 p90 -81.49 -24.54 36.66 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.283 179.234 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.8 m -79.98 -48.04 14.0 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-O 120.874 0.369 . . . . 0.0 110.616 179.885 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.725 HD13 ' HB2' ' A' ' 32' ' ' LEU . 2.1 mt -62.02 -32.36 72.84 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.863 179.26 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.439 ' HG3' ' HA ' ' A' ' 16' ' ' ALA . 4.0 tttm -67.67 -60.02 2.87 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.468 179.421 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -60.58 -30.23 69.68 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.301 179.748 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 -77.22 -52.29 9.48 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.974 179.802 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.694 HG22 ' O ' ' A' ' 45' ' ' LEU . 7.2 tp -60.25 -24.03 29.47 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.07 -179.943 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.602 HD13 ' CG ' ' A' ' 19' ' ' GLU . 3.3 tp -79.38 -32.84 43.16 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 178.469 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.859 HG23 HG23 ' A' ' 55' ' ' THR . 50.9 m -59.66 -37.46 78.81 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.915 179.205 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.802 ' CE1' HD12 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -74.09 56.86 0.62 Allowed 'General case' 0 CA--C 1.539 0.549 0 CA-C-O 121.58 0.705 . . . . 0.0 110.536 179.813 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.4 m 173.83 -67.26 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.147 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 179.827 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 3.0 t -83.24 -67.61 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.438 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.952 179.419 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.859 HG23 HG23 ' A' ' 51' ' ' THR . 0.2 OUTLIER 69.69 114.92 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.048 179.968 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.221 -0.895 . . . . 0.0 110.906 179.863 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 11.9 t . . . . . 0 N--CA 1.484 1.251 0 CA-C-O 120.809 0.337 . . . . 0.0 111.201 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -139.38 -67.04 0.45 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.668 -179.78 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 4.6 t80 58.66 25.39 13.24 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.142 0.496 . . . . 0.0 111.187 -179.696 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 13.0 ttpt -167.68 -65.53 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.001 179.925 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.2 mt 62.31 -85.12 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.119 179.961 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 34.7 mm 47.82 92.68 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.335 0 CA-C-O 120.564 0.221 . . . . 0.0 110.959 179.606 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -121.7 -169.29 1.84 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.035 0.445 . . . . 0.0 111.264 -179.834 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 175.75 -46.02 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.783 179.787 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.727 HD21 ' HB2' ' A' ' 36' ' ' ALA . 9.2 tt -67.12 -48.86 66.84 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 121.017 0.436 . . . . 0.0 110.721 179.649 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.465 ' HA ' ' HD3' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -52.21 -34.0 43.62 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.738 -0.664 . . . . 0.0 110.825 179.842 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.401 ' O ' ' HG3' ' A' ' 14' ' ' GLU . 0.8 OUTLIER -89.3 -29.67 19.0 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.775 179.802 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.4 -38.07 88.22 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.057 179.239 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.631 ' HB3' HG11 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -85.41 -35.45 21.3 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.037 179.704 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.544 ' O ' HG22 ' A' ' 17' ' ' ILE . 0.3 OUTLIER -59.9 -42.33 93.61 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 179.128 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -72.18 -30.93 65.45 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 177.833 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.649 ' CB ' HD12 ' A' ' 33' ' ' ILE . . . -68.67 -47.2 67.12 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.071 -0.968 . . . . 0.0 111.149 179.661 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.709 ' O ' HG23 ' A' ' 21' ' ' VAL . 0.5 OUTLIER -57.2 -39.24 65.95 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.235 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 179.145 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.09 -32.47 72.81 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 177.384 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.562 ' CG ' HD13 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -66.11 -49.59 66.99 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.478 179.152 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.796 HD22 ' HB ' ' A' ' 30' ' ' ILE . 0.2 OUTLIER -74.47 -35.75 63.28 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.948 -179.758 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.709 HG23 ' O ' ' A' ' 17' ' ' ILE . 44.0 t -63.4 -31.22 52.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 120.847 0.356 . . . . 0.0 110.21 179.461 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -89.51 -34.91 16.23 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.334 179.589 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.411 ' HB3' HD11 ' A' ' 25' ' ' ILE . . . -79.7 -14.97 58.37 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.355 179.779 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.654 ' O ' HG23 ' A' ' 25' ' ' ILE . . . 46.33 97.39 0.01 OUTLIER Glycine 0 CA--C 1.522 0.506 0 C-N-CA 121.051 -0.595 . . . . 0.0 113.287 179.603 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.721 ' N ' HD13 ' A' ' 25' ' ' ILE . 0.1 OUTLIER -162.09 -176.62 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.461 0.122 0 CA-C-N 116.884 0.342 . . . . 0.0 111.479 179.986 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -45.69 96.38 0.01 OUTLIER 'General case' 0 CA--C 1.518 -0.267 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.596 -179.452 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.539 ' O ' HG22 ' A' ' 30' ' ' ILE . 19.5 mm-40 -45.62 -25.11 0.42 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.194 178.681 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.402 ' CD ' HD21 ' A' ' 32' ' ' LEU . 0.1 OUTLIER -39.53 -50.59 2.19 Favored 'General case' 0 C--O 1.239 0.519 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.917 178.754 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.665 ' CG ' HD13 ' A' ' 49' ' ' ILE . 2.8 m-85 -65.47 -32.83 74.65 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.972 179.665 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.796 ' HB ' HD22 ' A' ' 20' ' ' LEU . 1.0 OUTLIER -59.76 -26.28 34.73 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.391 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.556 178.091 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.7 tttm -75.94 -37.81 58.28 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.455 179.494 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.636 ' HG ' ' HA ' ' A' ' 29' ' ' TYR . 0.1 OUTLIER -59.57 -33.03 70.92 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 120.18 -0.608 . . . . 0.0 109.766 179.308 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.744 HG22 ' HA ' ' A' ' 42' ' ' VAL . 3.8 pt -91.8 -45.9 14.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.967 179.573 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -58.48 -28.8 65.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.678 -179.866 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -88.62 -12.53 42.31 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.123 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.727 ' HB2' HD21 ' A' ' 9' ' ' LEU . . . 61.45 -140.02 0.5 Allowed 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 116.734 -0.212 . . . . 0.0 110.996 179.391 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.547 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 0.0 OUTLIER 96.33 -27.41 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 122.783 0.433 . . . . 0.0 110.758 -179.786 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.701 ' O ' HG23 ' A' ' 42' ' ' VAL . 0.6 OUTLIER -144.03 83.37 1.74 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.598 179.73 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.699 ' CA ' HD12 ' A' ' 9' ' ' LEU . 8.8 p -40.77 -48.18 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.464 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.475 -179.879 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.518 ' N ' HG13 ' A' ' 39' ' ' VAL . 0.0 OUTLIER -61.86 -43.0 99.73 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.846 -0.427 . . . . 0.0 109.846 179.304 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.475 ' O ' ' N ' ' A' ' 45' ' ' LEU . . . -66.58 -46.51 75.99 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.522 -0.847 . . . . 0.0 111.762 178.879 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.744 ' HA ' HG22 ' A' ' 33' ' ' ILE . 10.6 t -45.29 -41.97 2.93 Favored 'Isoleucine or valine' 0 C--O 1.233 0.201 0 CA-C-O 121.287 0.565 . . . . 0.0 110.196 179.168 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 14.3 t90 -76.76 -30.28 56.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.987 179.255 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.5 m -82.43 -54.62 5.06 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.831 0.348 . . . . 0.0 111.161 -179.782 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.688 ' O ' HG22 ' A' ' 49' ' ' ILE . 3.9 mm? -52.93 -32.49 45.94 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 179.306 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.5 ' HG3' ' HA ' ' A' ' 16' ' ' ALA . 0.3 OUTLIER -70.02 -60.77 2.09 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.271 -0.877 . . . . 0.0 110.245 179.296 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -58.25 -31.91 67.86 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.196 179.656 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -75.49 -54.98 6.14 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.836 179.763 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.688 HG22 ' O ' ' A' ' 45' ' ' LEU . 7.7 tp -56.84 -23.88 18.71 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.188 0 C-N-CA 120.705 -0.398 . . . . 0.0 111.236 -179.85 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.566 ' O ' HG23 ' A' ' 54' ' ' VAL . 4.2 tp -79.04 -34.91 43.42 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 178.931 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.45 ' HA ' HG23 ' A' ' 54' ' ' VAL . 17.4 m -66.06 -18.05 65.09 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.755 179.719 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.551 ' CG ' ' O ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -88.85 34.32 0.78 Allowed 'General case' 0 CA--C 1.532 0.257 0 CA-C-O 121.467 0.651 . . . . 0.0 111.215 -179.732 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.8 m 177.59 -67.69 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.145 -0.934 . . . . 0.0 109.202 179.488 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.566 HG23 ' O ' ' A' ' 50' ' ' LEU . 67.6 t 55.09 93.26 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.452 -0.374 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.168 179.202 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 75.4 m -122.56 75.07 1.23 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.831 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.25 1.093 0 CA-C-O 118.166 -0.921 . . . . 0.0 110.856 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.647 HD13 ' HB1' ' A' ' 36' ' ' ALA . 2.4 pp . . . . . 0 N--CA 1.458 -0.072 0 CA-C-O 120.655 0.264 . . . . 0.0 111.056 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 17.4 tttm -54.36 -38.32 65.95 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.146 0.498 . . . . 0.0 110.354 179.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.403 ' HA ' ' HB2' ' A' ' 14' ' ' GLU . 0.1 OUTLIER -90.43 -32.91 16.21 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.388 179.393 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.539 ' HB3' ' HA ' ' A' ' 9' ' ' LEU . . . -60.06 -38.27 82.32 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.504 179.377 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.594 ' HB3' HG11 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -85.41 -36.85 20.41 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.445 179.352 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.466 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 6.1 mm-40 -56.48 -50.45 71.73 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 178.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -64.17 -34.24 77.62 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 177.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.593 ' HB1' ' CD1' ' A' ' 33' ' ' ILE . . . -65.19 -38.87 91.83 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.4 179.391 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.722 ' O ' HG23 ' A' ' 21' ' ' VAL . 26.1 mm -55.62 -50.03 69.85 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.168 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 178.767 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -60.62 -33.18 72.4 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.736 -0.666 . . . . 0.0 109.964 178.642 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.647 ' HB3' HD13 ' A' ' 50' ' ' LEU . 0.1 OUTLIER -61.74 -52.47 64.12 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.661 179.496 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.744 HD22 ' HB ' ' A' ' 30' ' ' ILE . 0.2 OUTLIER -76.08 -34.28 59.54 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.673 179.886 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.722 HG23 ' O ' ' A' ' 17' ' ' ILE . 64.1 t -64.43 -31.2 52.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-O 120.866 0.365 . . . . 0.0 110.086 179.38 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -88.24 -35.95 17.02 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.203 179.313 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.845 ' HB3' HD11 ' A' ' 25' ' ' ILE . . . -78.84 -15.37 58.46 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.245 179.536 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 41.87 79.69 0.05 OUTLIER Glycine 0 CA--C 1.522 0.508 0 CA-C-N 116.307 -0.406 . . . . 0.0 113.799 179.451 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.845 HD11 ' HB3' ' A' ' 23' ' ' ALA . 0.1 OUTLIER -144.2 -162.63 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.233 0 CA-C-N 116.812 0.306 . . . . 0.0 110.999 179.346 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -43.25 95.45 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.185 0 CA-C-O 120.863 0.364 . . . . 0.0 111.801 -179.497 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.635 ' O ' HG22 ' A' ' 30' ' ' ILE . 0.4 OUTLIER -52.87 -26.03 13.48 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.576 179.504 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.96 -45.92 15.95 Favored 'General case' 0 C--O 1.237 0.445 0 CA-C-O 121.344 0.592 . . . . 0.0 110.294 179.223 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.826 ' CD1' HD13 ' A' ' 49' ' ' ILE . 4.0 m-85 -62.69 -31.82 72.79 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.074 179.657 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.744 ' HB ' HD22 ' A' ' 20' ' ' LEU . 1.8 tt -60.9 -26.56 39.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.0 -0.545 . . . . 0.0 109.659 178.445 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -76.62 -37.64 56.04 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.879 179.738 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.588 ' HG ' ' O ' ' A' ' 29' ' ' TYR . 0.0 OUTLIER -60.99 -32.29 71.87 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 120.034 -0.666 . . . . 0.0 109.941 179.51 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.593 ' CD1' ' HB1' ' A' ' 16' ' ' ALA . 3.9 pt -91.86 -45.99 14.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.017 179.365 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.38 -29.68 67.88 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.879 -179.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -87.29 -14.55 40.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.006 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.647 ' HB1' HD13 ' A' ' 9' ' ' LEU . . . 57.75 -131.71 1.36 Allowed 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.115 179.822 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.459 ' HB2' ' O ' ' A' ' 36' ' ' ALA . 0.0 OUTLIER 85.1 -19.24 0.34 Allowed 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 122.611 0.364 . . . . 0.0 111.131 -179.737 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.654 ' O ' HG23 ' A' ' 42' ' ' VAL . 0.2 OUTLIER -147.17 77.78 1.46 Allowed 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 179.583 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.521 HG13 ' N ' ' A' ' 40' ' ' GLU . 14.9 p -40.64 -49.19 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.953 -179.378 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.521 ' N ' HG13 ' A' ' 39' ' ' VAL . 0.4 OUTLIER -59.17 -42.68 91.38 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.778 -0.452 . . . . 0.0 109.778 179.373 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -69.15 -47.1 55.32 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.432 -0.889 . . . . 0.0 111.983 178.791 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.654 HG23 ' O ' ' A' ' 38' ' ' THR . 21.3 t -43.5 -41.59 1.43 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.249 0 CA-C-O 121.135 0.493 . . . . 0.0 110.538 179.322 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 39.2 t-105 -78.18 -32.16 49.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.784 -0.643 . . . . 0.0 110.988 179.512 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.8 m -78.47 -47.37 17.58 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.962 0.41 . . . . 0.0 110.992 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.71 ' O ' HG22 ' A' ' 49' ' ' ILE . 3.8 mm? -58.5 -35.1 71.7 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.228 179.525 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.451 ' HD3' ' HB2' ' A' ' 16' ' ' ALA . 1.7 ttpm? -68.12 -59.99 2.82 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.403 179.493 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.11 -31.58 69.06 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.361 179.797 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -77.42 -53.5 7.58 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 115.916 -0.583 . . . . 0.0 111.054 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.826 HD13 ' CD1' ' A' ' 29' ' ' TYR . 7.5 tp -57.01 -24.14 19.78 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.194 0 C-N-CA 120.702 -0.399 . . . . 0.0 111.203 -179.756 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.647 HD13 ' HB3' ' A' ' 19' ' ' GLU . 2.2 tp -80.13 -36.46 35.21 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 178.697 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 23.7 m -57.29 -24.64 56.24 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.622 178.831 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.577 ' CE1' HG21 ' A' ' 25' ' ' ILE . 0.0 OUTLIER . . . . . 0 CA--C 1.533 0.29 0 CA-C-O 120.811 0.338 . . . . 0.0 111.042 179.647 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.653 HD13 ' HB1' ' A' ' 36' ' ' ALA . 2.6 pp . . . . . 0 N--CA 1.455 -0.181 0 CA-C-O 120.887 0.375 . . . . 0.0 111.068 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.423 ' HA ' ' HD3' ' A' ' 13' ' ' LYS . 0.6 OUTLIER -52.22 -35.93 50.84 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.398 179.712 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 4.5 mt-30 -90.51 -32.52 16.3 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.467 179.442 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.429 ' HB3' ' HA ' ' A' ' 9' ' ' LEU . . . -60.81 -37.75 83.05 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.371 179.451 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.586 ' HB3' HG11 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -85.46 -37.47 19.71 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.419 179.466 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.476 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 5.8 mm-40 -57.77 -50.45 73.22 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 179.173 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -65.27 -32.46 74.13 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 177.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.547 ' HB1' ' CD1' ' A' ' 33' ' ' ILE . . . -66.97 -37.5 84.36 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.42 179.437 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.774 ' O ' HG23 ' A' ' 21' ' ' VAL . 21.0 mm -57.45 -48.21 83.3 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.14 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 178.713 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 18.4 mttt -63.59 -33.3 75.31 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.822 178.568 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.815 ' HB3' HD13 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -59.96 -52.24 66.24 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.692 179.53 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.575 HD22 ' HB ' ' A' ' 30' ' ' ILE . 0.3 OUTLIER -75.86 -32.41 59.73 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.747 -179.852 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.774 HG23 ' O ' ' A' ' 17' ' ' ILE . 53.9 t -64.3 -31.25 52.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.252 179.408 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -90.32 -38.3 13.46 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.436 179.591 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.454 ' O ' HG13 ' A' ' 25' ' ' ILE . . . -78.77 -15.55 58.28 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.438 179.797 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.721 ' O ' HG23 ' A' ' 25' ' ' ILE . . . 40.58 90.04 0.01 OUTLIER Glycine 0 C--N 1.335 0.515 0 CA-C-N 116.344 -0.389 . . . . 0.0 113.739 179.381 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.721 HG23 ' O ' ' A' ' 24' ' ' GLY . 0.4 OUTLIER -176.2 136.2 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.227 0 CA-C-O 121.072 0.463 . . . . 0.0 111.707 179.445 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . 38.11 89.97 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 115.616 -0.72 . . . . 0.0 112.558 179.696 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.634 ' O ' HG22 ' A' ' 30' ' ' ILE . 0.0 OUTLIER -62.82 -29.38 70.69 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.283 0.563 . . . . 0.0 109.637 178.557 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 2.6 tptt -46.08 -45.19 16.07 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.481 179.11 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.58 ' HA ' ' HG ' ' A' ' 32' ' ' LEU . 3.6 m-85 -64.0 -31.63 72.88 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.085 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.634 HG22 ' O ' ' A' ' 27' ' ' GLU . 1.6 tt -60.94 -26.19 38.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.732 178.322 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 12.7 tttt -77.89 -37.58 47.67 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.057 179.729 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.629 ' HB2' HD13 ' A' ' 45' ' ' LEU . 0.0 OUTLIER -60.69 -32.07 71.31 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 120.214 -0.594 . . . . 0.0 109.839 179.688 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.547 ' CD1' ' HB1' ' A' ' 16' ' ' ALA . 5.0 pt -91.7 -45.83 14.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.986 179.47 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.404 ' HB2' HD11 ' A' ' 17' ' ' ILE . . . -60.35 -29.09 68.67 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.003 -179.799 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 -86.47 -15.8 39.04 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.253 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.653 ' HB1' HD13 ' A' ' 9' ' ' LEU . . . 59.22 -139.4 0.72 Allowed 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 116.662 -0.245 . . . . 0.0 110.893 179.634 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.527 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 1.4 tptt 94.81 -26.71 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 122.688 0.395 . . . . 0.0 110.855 -179.691 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.667 ' O ' HG23 ' A' ' 42' ' ' VAL . 1.2 m -142.95 82.45 1.76 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.461 179.588 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.526 HG23 ' HB3' ' A' ' 9' ' ' LEU . 11.5 p -41.29 -47.66 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.568 -179.484 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.514 ' N ' HG13 ' A' ' 39' ' ' VAL . 1.8 mt-10 -60.39 -43.92 96.15 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.877 -0.416 . . . . 0.0 109.877 179.292 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.634 ' O ' ' HG ' ' A' ' 45' ' ' LEU . . . -67.91 -47.23 61.61 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 120.424 -0.893 . . . . 0.0 111.948 178.815 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.667 HG23 ' O ' ' A' ' 38' ' ' THR . 21.9 t -43.72 -41.52 1.56 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.259 0 CA-C-O 121.177 0.513 . . . . 0.0 110.584 179.195 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 37.0 t90 -78.59 -30.88 46.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.086 179.497 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.8 m -78.88 -44.93 21.74 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 120.722 0.296 . . . . 0.0 111.105 -179.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.703 ' O ' HG22 ' A' ' 49' ' ' ILE . 1.2 mt -61.86 -34.13 75.43 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.044 179.572 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.469 ' HG3' ' HA ' ' A' ' 16' ' ' ALA . 1.2 ttpt -68.38 -60.72 2.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.473 179.539 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -58.08 -30.51 66.28 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.247 179.713 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.61 -54.0 6.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.922 179.769 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.703 HG22 ' O ' ' A' ' 45' ' ' LEU . 5.3 tp -57.67 -24.06 21.68 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.141 0 C-N-CA 120.9 -0.32 . . . . 0.0 111.193 -179.892 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.815 HD13 ' HB3' ' A' ' 19' ' ' GLU . 4.3 tp -80.29 -35.86 35.21 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 178.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 17.3 m -66.26 -15.91 63.59 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.788 179.695 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.537 ' CG ' ' O ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER . . . . . 0 N--CA 1.462 0.165 0 CA-C-O 121.158 0.504 . . . . 0.0 111.509 -179.478 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.795 HD13 ' HB1' ' A' ' 36' ' ' ALA . 2.6 pp . . . . . 0 N--CA 1.457 -0.089 0 CA-C-O 120.84 0.352 . . . . 0.0 111.073 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.431 ' HA ' ' HD3' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -50.85 -37.91 46.01 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.092 0.473 . . . . 0.0 110.627 -179.958 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.0 -32.77 16.62 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.536 179.787 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.425 ' HB3' ' HA ' ' A' ' 9' ' ' LEU . . . -60.91 -37.52 82.56 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.498 179.46 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.531 ' HB3' HG11 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -85.35 -37.54 19.79 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.477 179.371 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.479 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 2.8 mm-40 -56.86 -50.56 72.1 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 178.947 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -64.33 -34.69 78.74 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 177.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.519 ' HB1' ' CD1' ' A' ' 33' ' ' ILE . . . -64.46 -37.98 89.41 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.225 179.286 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.817 ' O ' HG23 ' A' ' 21' ' ' VAL . 23.6 mm -56.3 -47.53 81.0 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.158 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 178.689 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 18.2 mttp -62.86 -33.27 74.92 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.912 178.684 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.584 ' CG ' HD13 ' A' ' 50' ' ' LEU . 0.6 OUTLIER -61.42 -52.31 65.12 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.636 179.549 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.746 HD22 ' HB ' ' A' ' 30' ' ' ILE . 0.2 OUTLIER -72.51 -35.03 68.02 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.772 -179.963 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.817 HG23 ' O ' ' A' ' 17' ' ' ILE . 70.2 t -63.27 -31.17 51.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 120.809 0.338 . . . . 0.0 110.244 179.36 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -88.86 -36.09 16.18 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.463 179.508 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.745 ' HB3' HD11 ' A' ' 25' ' ' ILE . . . -78.32 -15.42 58.74 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.341 179.715 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.402 ' C ' HG13 ' A' ' 25' ' ' ILE . . . 41.34 90.43 0.01 OUTLIER Glycine 0 CA--C 1.524 0.612 0 C-N-CA 121.507 -0.378 . . . . 0.0 113.792 179.44 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.745 HD11 ' HB3' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -156.32 -163.54 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 CA-C-N 116.649 0.224 . . . . 0.0 110.915 179.387 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -45.17 95.07 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 120.823 0.344 . . . . 0.0 111.699 -179.613 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.565 ' O ' HG22 ' A' ' 30' ' ' ILE . 7.8 mt-10 -52.24 -25.64 9.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.778 179.455 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -45.38 -46.81 13.42 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.593 179.402 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.642 ' HA ' ' HG ' ' A' ' 32' ' ' LEU . 1.1 m-85 -62.46 -30.42 71.23 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.283 0.563 . . . . 0.0 109.919 179.706 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.746 ' HB ' HD22 ' A' ' 20' ' ' LEU . 1.3 tt -60.81 -26.25 37.91 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.361 0 CA-C-N 115.778 -0.646 . . . . 0.0 109.361 177.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.42 -37.2 57.41 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.64 179.607 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.642 ' HG ' ' HA ' ' A' ' 29' ' ' TYR . 0.1 OUTLIER -59.82 -33.89 72.35 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 120.068 -0.653 . . . . 0.0 109.813 179.359 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.519 ' CD1' ' HB1' ' A' ' 16' ' ' ALA . 4.2 pt -90.78 -46.71 14.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.966 179.541 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.408 ' HB2' HD11 ' A' ' 17' ' ' ILE . . . -57.6 -28.64 63.81 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.774 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 16.6 t-20 -89.43 -15.72 32.54 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.944 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.795 ' HB1' HD13 ' A' ' 9' ' ' LEU . . . 59.08 -134.95 0.89 Allowed 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 116.67 -0.241 . . . . 0.0 110.964 179.633 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.492 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 5.6 ttmm 89.98 -22.61 0.11 Allowed 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 122.699 0.4 . . . . 0.0 111.145 -179.894 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.657 ' O ' HG23 ' A' ' 42' ' ' VAL . 1.2 m -145.67 79.0 1.56 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.396 179.675 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.513 HG13 ' N ' ' A' ' 40' ' ' GLU . 10.0 p -39.54 -48.54 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.426 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.641 -179.63 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.513 ' N ' HG13 ' A' ' 39' ' ' VAL . 3.1 mt-10 -58.08 -45.72 86.66 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 179.369 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -69.13 -43.59 71.09 Favored Glycine 0 N--CA 1.447 -0.594 0 C-N-CA 120.408 -0.901 . . . . 0.0 112.182 178.844 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.657 HG23 ' O ' ' A' ' 38' ' ' THR . 23.7 t -43.27 -46.69 1.49 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.175 0 CA-C-O 120.879 0.371 . . . . 0.0 110.834 179.696 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.491 ' CZ2' ' HA ' ' A' ' 40' ' ' GLU . 1.1 p90 -78.47 -27.52 46.33 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 120.612 -0.435 . . . . 0.0 110.979 179.277 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.434 ' N ' ' CD1' ' A' ' 43' ' ' TRP . 3.2 m -76.62 -49.28 16.64 Favored 'General case' 0 N--CA 1.463 0.184 0 C-N-CA 120.75 -0.38 . . . . 0.0 110.839 179.825 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.699 ' O ' HG22 ' A' ' 49' ' ' ILE . 3.6 mt -59.79 -33.07 71.23 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.224 179.585 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.415 ' HD2' ' HA ' ' A' ' 16' ' ' ALA . 6.7 ttpt -67.97 -59.0 3.6 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.359 179.562 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -60.66 -31.71 70.92 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.241 179.689 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -76.23 -52.64 9.61 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.931 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.699 HG22 ' O ' ' A' ' 45' ' ' LEU . 7.4 tp -58.43 -23.97 23.83 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.257 0 C-N-CA 120.784 -0.367 . . . . 0.0 111.16 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.584 HD13 ' CG ' ' A' ' 19' ' ' GLU . 1.5 tp -79.24 -34.94 42.3 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 178.549 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 34.3 m -61.26 -24.32 66.3 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.313 179.238 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.58 ' CE1' HG21 ' A' ' 25' ' ' ILE . 0.0 OUTLIER . . . . . 0 CA--C 1.533 0.296 0 CA-C-O 120.914 0.388 . . . . 0.0 111.179 -179.88 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.524 ' HB3' HG23 ' A' ' 39' ' ' VAL . 3.0 pp . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.909 0.385 . . . . 0.0 110.627 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.435 ' HA ' ' HD3' ' A' ' 13' ' ' LYS . 0.7 OUTLIER -53.61 -37.8 63.38 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.247 179.55 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.408 ' HA ' ' HB2' ' A' ' 14' ' ' GLU . 1.7 tt0 -89.88 -32.64 16.78 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.347 179.441 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.482 ' HB3' ' HA ' ' A' ' 9' ' ' LEU . . . -59.88 -38.28 81.76 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.321 179.371 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.579 ' HB3' HG11 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -85.46 -35.16 21.4 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.636 179.394 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.848 ' O ' HG22 ' A' ' 17' ' ' ILE . 2.1 mm-40 -60.43 -50.44 73.57 Favored 'General case' 0 C--O 1.234 0.263 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 179.049 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -64.41 -34.49 78.3 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 178.026 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.505 ' HB1' ' CD1' ' A' ' 33' ' ' ILE . . . -67.26 -36.34 81.4 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 115.177 -0.919 . . . . 0.0 110.436 179.587 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.848 HG22 ' O ' ' A' ' 14' ' ' GLU . 1.8 tp -59.9 -33.55 53.06 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.209 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 179.18 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 4.5 mttp -76.7 -33.21 58.23 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.583 178.348 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.582 ' CG ' HD13 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -59.05 -52.44 65.72 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.677 179.419 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.734 HD22 ' HB ' ' A' ' 30' ' ' ILE . 0.3 OUTLIER -71.41 -35.86 71.13 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.895 -179.842 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.744 HG23 ' O ' ' A' ' 17' ' ' ILE . 41.1 t -62.33 -31.28 51.18 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-O 120.982 0.42 . . . . 0.0 110.119 179.28 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -88.58 -35.27 16.99 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.96 179.14 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -77.12 -15.19 59.64 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.17 179.45 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 39.66 85.93 0.01 OUTLIER Glycine 0 CA--C 1.521 0.449 0 CA-C-N 116.235 -0.439 . . . . 0.0 113.905 179.358 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.649 HD12 ' HG ' ' A' ' 20' ' ' LEU . 0.8 OUTLIER -163.41 -171.18 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 CA-C-N 116.716 0.258 . . . . 0.0 111.118 179.15 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.409 ' O ' HD21 ' A' ' 20' ' ' LEU . . . -28.78 95.73 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -179.096 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.616 ' O ' HG22 ' A' ' 30' ' ' ILE . 0.3 OUTLIER -58.96 -25.54 63.65 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.464 179.46 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -44.15 -46.6 8.84 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.681 179.473 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.934 ' CG ' HD13 ' A' ' 49' ' ' ILE . 3.5 m-85 -62.39 -31.24 71.88 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.291 0.567 . . . . 0.0 110.169 179.743 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.734 ' HB ' HD22 ' A' ' 20' ' ' LEU . 1.9 tt -60.79 -26.28 37.94 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.485 178.149 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 13.9 tttt -76.54 -37.13 57.14 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.704 179.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.618 ' HG ' ' HA ' ' A' ' 29' ' ' TYR . 0.1 OUTLIER -60.73 -32.67 71.93 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 120.095 -0.642 . . . . 0.0 109.834 179.494 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.505 ' CD1' ' HB1' ' A' ' 16' ' ' ALA . 5.1 pt -91.5 -45.62 14.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.966 179.444 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.56 -28.94 67.56 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.868 -179.823 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 20.6 t30 -87.97 -14.37 39.34 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.174 -179.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.533 ' O ' ' CB ' ' A' ' 37' ' ' LYS . . . 57.28 -139.42 0.88 Allowed 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 116.738 -0.21 . . . . 0.0 111.085 179.553 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.533 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 0.9 OUTLIER 95.44 -27.38 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 122.843 0.457 . . . . 0.0 110.734 -179.752 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.652 ' O ' HG23 ' A' ' 42' ' ' VAL . 1.0 OUTLIER -142.25 82.89 1.81 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.3 179.564 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.524 HG23 ' HB3' ' A' ' 9' ' ' LEU . 14.8 p -41.83 -47.21 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.307 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.658 -179.64 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.511 ' N ' HG13 ' A' ' 39' ' ' VAL . 0.0 OUTLIER -60.2 -43.29 96.04 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 179.254 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -68.87 -46.96 58.04 Favored Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.481 -0.866 . . . . 0.0 112.008 178.791 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.652 HG23 ' O ' ' A' ' 38' ' ' THR . 21.7 t -43.88 -41.88 1.7 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-O 121.135 0.493 . . . . 0.0 110.518 179.18 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 64.1 t-105 -77.71 -31.69 52.45 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.094 179.438 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.8 m -78.61 -44.6 23.56 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 120.748 0.309 . . . . 0.0 111.085 -179.831 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.689 ' O ' HG22 ' A' ' 49' ' ' ILE . 3.8 mm? -60.58 -35.07 75.19 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.083 179.479 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.447 ' CD ' ' HB2' ' A' ' 16' ' ' ALA . 0.8 OUTLIER -68.24 -60.38 2.51 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.459 179.554 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -59.47 -29.73 68.03 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.322 179.739 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -78.14 -54.24 6.47 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.974 179.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.934 HD13 ' CG ' ' A' ' 29' ' ' TYR . 8.6 tp -56.1 -24.32 17.48 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 C-N-CA 120.828 -0.349 . . . . 0.0 111.061 -179.735 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.582 HD13 ' CG ' ' A' ' 19' ' ' GLU . 1.2 tp -81.07 -35.7 31.4 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 178.526 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 7.5 m -55.58 -27.37 48.87 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.244 178.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.603 ' HD2' ' O ' ' A' ' 49' ' ' ILE . 0.0 OUTLIER . . . . . 0 CA--C 1.531 0.223 0 CA-C-O 120.874 0.369 . . . . 0.0 110.27 178.836 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.765 HD13 ' HB1' ' A' ' 36' ' ' ALA . 3.1 pp . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.741 0.305 . . . . 0.0 110.912 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 7.7 tttm -52.03 -38.84 58.33 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.032 0.444 . . . . 0.0 110.514 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.28 -33.2 18.13 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.445 179.553 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.452 ' HB3' ' HA ' ' A' ' 9' ' ' LEU . . . -59.64 -37.54 78.94 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.584 179.465 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.578 ' HB3' HG11 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -85.42 -35.97 20.96 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.526 179.425 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.46 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 23.9 mt-10 -57.04 -50.41 72.84 Favored 'General case' 0 C--O 1.237 0.403 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 178.915 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -63.96 -33.89 76.75 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 177.666 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.581 ' HB1' ' CD1' ' A' ' 33' ' ' ILE . . . -64.55 -38.49 91.18 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.205 179.246 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.875 ' O ' HG23 ' A' ' 21' ' ' VAL . 26.7 mm -56.12 -52.49 50.01 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.13 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 178.823 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.38 -33.06 70.73 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.845 178.58 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.556 ' CG ' HD13 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -59.95 -52.24 66.23 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.382 179.324 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.776 HD22 ' HB ' ' A' ' 30' ' ' ILE . 0.3 OUTLIER -72.74 -32.31 65.58 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.418 179.748 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.875 HG23 ' O ' ' A' ' 17' ' ' ILE . 87.9 t -62.6 -32.11 54.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 120.904 0.383 . . . . 0.0 110.276 179.328 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.407 ' OD2' ' HA ' ' A' ' 19' ' ' GLU . 1.5 p30 -88.19 -40.12 13.95 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.28 179.412 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.32 -15.28 60.96 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.178 179.424 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.421 ' C ' HG13 ' A' ' 25' ' ' ILE . . . 37.57 89.55 0.01 OUTLIER Glycine 0 CA--C 1.522 0.525 0 CA-C-N 116.121 -0.491 . . . . 0.0 114.036 179.296 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.703 HD12 ' HG ' ' A' ' 20' ' ' LEU . 0.5 OUTLIER -159.08 -168.83 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.214 0 CA-C-N 116.653 0.227 . . . . 0.0 111.058 179.285 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -33.47 95.73 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -179.269 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.655 ' O ' HG22 ' A' ' 30' ' ' ILE . 1.3 mp0 -54.41 -25.68 26.16 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.562 179.562 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.4 tptt -44.57 -46.37 9.94 Favored 'General case' 0 C--O 1.238 0.489 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.608 179.519 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.579 ' HA ' ' HG ' ' A' ' 32' ' ' LEU . 3.3 m-85 -62.97 -31.66 72.82 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.189 0.518 . . . . 0.0 110.209 179.819 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.776 ' HB ' HD22 ' A' ' 20' ' ' LEU . 2.0 tt -60.61 -26.17 37.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.683 178.347 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 7.1 tptt -77.44 -37.67 51.13 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.884 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.579 ' HG ' ' HA ' ' A' ' 29' ' ' TYR . 0.0 OUTLIER -60.96 -31.88 71.43 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 120.044 -0.662 . . . . 0.0 110.027 179.583 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.581 ' CD1' ' HB1' ' A' ' 16' ' ' ALA . 3.2 pt -91.72 -46.05 14.4 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.938 179.371 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -58.75 -28.87 66.31 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.953 -179.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 16.6 t-20 -89.12 -13.54 38.27 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.058 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.765 ' HB1' HD13 ' A' ' 9' ' ' LEU . . . 58.14 -136.32 0.95 Allowed 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 116.69 -0.232 . . . . 0.0 111.054 179.643 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.529 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 24.2 tttt 94.8 -26.86 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 122.767 0.427 . . . . 0.0 110.718 -179.701 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.649 ' O ' HG23 ' A' ' 42' ' ' VAL . 0.2 OUTLIER -144.4 83.17 1.71 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.31 179.673 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.505 HG13 ' N ' ' A' ' 40' ' ' GLU . 12.9 p -41.34 -47.52 0.79 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.651 -179.598 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.505 ' N ' HG13 ' A' ' 39' ' ' VAL . 0.4 OUTLIER -60.6 -43.27 97.61 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 179.194 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.581 ' O ' ' HG ' ' A' ' 45' ' ' LEU . . . -67.75 -46.52 67.27 Favored Glycine 0 N--CA 1.448 -0.567 0 C-N-CA 120.526 -0.845 . . . . 0.0 111.884 178.774 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.649 HG23 ' O ' ' A' ' 38' ' ' THR . 20.7 t -45.19 -39.63 2.25 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 CA-C-O 121.171 0.51 . . . . 0.0 110.494 179.281 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 1.9 t90 -79.56 -30.41 41.67 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.87 179.336 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.7 m -78.93 -48.25 14.92 Favored 'General case' 0 C--N 1.334 -0.084 0 CA-C-O 120.892 0.377 . . . . 0.0 110.836 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.746 ' O ' HG22 ' A' ' 49' ' ' ILE . 1.5 mt -59.3 -34.7 72.62 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.145 179.564 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.484 ' HD3' ' HB2' ' A' ' 16' ' ' ALA . 3.5 ttpp -68.51 -59.02 3.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.416 179.495 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.02 -30.1 67.76 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.223 179.676 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -78.04 -54.32 6.41 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.847 179.713 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.746 HG22 ' O ' ' A' ' 45' ' ' LEU . 4.1 tp -56.6 -23.93 18.15 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.208 0 C-N-CA 120.858 -0.337 . . . . 0.0 110.923 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.556 HD13 ' CG ' ' A' ' 19' ' ' GLU . 3.4 tp -80.74 -33.52 35.06 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 178.525 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 38.1 m -60.13 -26.34 66.19 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.617 -0.72 . . . . 0.0 111.199 179.462 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.759 ' CG ' ' O ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.537 0.466 0 CA-C-O 121.466 0.651 . . . . 0.0 111.01 -179.803 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.757 HD13 ' HB1' ' A' ' 36' ' ' ALA . 3.1 pp . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.813 0.339 . . . . 0.0 110.977 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.43 ' HA ' ' HD3' ' A' ' 13' ' ' LYS . 12.4 tttp -50.66 -37.38 40.54 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.571 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -89.97 -29.26 18.58 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.703 179.705 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.99 -38.25 90.41 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.172 179.298 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.562 ' HB3' HG11 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -85.6 -35.26 21.13 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.06 179.725 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.74 ' O ' HG22 ' A' ' 17' ' ' ILE . 0.4 OUTLIER -59.15 -43.96 92.07 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.58 0.705 . . . . 0.0 109.238 179.035 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -70.75 -31.08 67.76 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.442 -0.799 . . . . 0.0 108.973 177.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.595 ' HB1' ' CD1' ' A' ' 33' ' ' ILE . . . -70.42 -41.82 72.42 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 115.217 -0.901 . . . . 0.0 111.307 -179.743 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.74 HG22 ' O ' ' A' ' 14' ' ' GLU . 0.8 OUTLIER -60.09 -35.51 61.91 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.285 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 179.305 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -70.48 -32.5 70.04 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 108.979 -0.749 . . . . 0.0 108.979 177.54 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.612 ' HG3' HD13 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -63.44 -52.53 61.08 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.16 -0.927 . . . . 0.0 111.266 179.801 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.454 ' HG ' HG13 ' A' ' 25' ' ' ILE . 0.2 OUTLIER -77.45 -35.18 54.16 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.192 -179.461 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.566 HG23 ' O ' ' A' ' 17' ' ' ILE . 37.1 t -65.22 -31.01 52.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 120.883 0.373 . . . . 0.0 110.298 179.57 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 23.2 m-20 -91.12 -33.18 15.56 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.7 179.747 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -83.8 -14.96 50.13 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.526 179.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.425 ' C ' ' CG1' ' A' ' 25' ' ' ILE . . . 55.18 112.46 0.01 OUTLIER Glycine 0 CA--C 1.523 0.586 0 C-N-CA 121.071 -0.585 . . . . 0.0 112.951 179.481 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.562 HG21 ' CE1' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -178.82 -173.69 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.357 0 CA-C-N 117.165 0.482 . . . . 0.0 111.407 179.478 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -43.77 94.56 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.133 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.832 -179.421 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.585 ' O ' HG22 ' A' ' 30' ' ' ILE . 3.0 mt-10 -50.86 -26.74 6.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.528 179.347 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -46.67 -46.33 19.9 Favored 'General case' 0 C--O 1.238 0.483 0 CA-C-O 121.325 0.584 . . . . 0.0 110.211 179.055 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.701 ' CG ' HD13 ' A' ' 49' ' ' ILE . 3.0 m-85 -62.08 -32.13 72.64 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 121.41 0.624 . . . . 0.0 109.767 179.413 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.585 HG22 ' O ' ' A' ' 27' ' ' GLU . 1.2 tt -60.59 -26.25 37.2 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.659 178.31 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.4 ttpt -76.2 -36.56 58.56 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.606 179.471 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.89 ' HB2' HD23 ' A' ' 45' ' ' LEU . 0.2 OUTLIER -59.73 -34.03 72.4 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 120.394 -0.523 . . . . 0.0 109.76 179.188 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.601 HG22 ' HA ' ' A' ' 42' ' ' VAL . 2.9 pt -91.82 -45.56 14.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.959 179.6 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.67 -29.41 68.04 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.771 -179.836 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 30.7 t30 -87.39 -12.68 45.55 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.031 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.757 ' HB1' HD13 ' A' ' 9' ' ' LEU . . . 59.28 -134.31 0.9 Allowed 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.062 179.675 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.52 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 1.0 OUTLIER 92.9 -40.59 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 122.79 0.436 . . . . 0.0 110.537 -179.686 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.612 ' O ' HG23 ' A' ' 42' ' ' VAL . 13.8 p -129.97 82.47 2.07 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.25 179.476 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.536 HG13 ' N ' ' A' ' 40' ' ' GLU . 12.6 p -41.69 -49.14 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.358 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.772 -179.63 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.536 ' N ' HG13 ' A' ' 39' ' ' VAL . 0.1 OUTLIER -58.34 -41.83 85.52 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 179.168 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -68.96 -47.67 53.03 Favored Glycine 0 N--CA 1.448 -0.554 0 C-N-CA 120.609 -0.805 . . . . 0.0 111.982 178.811 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.612 HG23 ' O ' ' A' ' 38' ' ' THR . 17.4 t -42.84 -40.78 1.04 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.192 0 CA-C-O 121.191 0.52 . . . . 0.0 110.493 179.23 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 68.0 t-105 -79.21 -32.89 44.12 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.199 179.342 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.6 m -79.79 -49.62 11.75 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-O 120.997 0.427 . . . . 0.0 111.021 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.89 HD23 ' HB2' ' A' ' 32' ' ' LEU . 0.4 OUTLIER -56.81 -34.97 68.21 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.033 179.428 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.447 ' HG3' ' HA ' ' A' ' 16' ' ' ALA . 3.5 tttm -68.54 -60.21 2.59 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.4 179.341 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -57.98 -32.27 67.73 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.415 179.714 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -76.18 -53.49 8.2 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.08 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.71 HG22 ' O ' ' A' ' 45' ' ' LEU . 7.3 tp -57.38 -24.28 21.24 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.171 0 C-N-CA 120.649 -0.42 . . . . 0.0 111.265 -179.777 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.612 HD13 ' HG3' ' A' ' 19' ' ' GLU . 2.2 tp -79.24 -35.84 40.91 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 178.794 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 44.1 m -59.31 -25.44 64.16 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.011 178.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.562 ' CE1' HG21 ' A' ' 25' ' ' ILE . 0.0 OUTLIER . . . . . 0 CA--C 1.532 0.284 0 CA-C-O 120.924 0.392 . . . . 0.0 111.042 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.77 HD13 ' HB1' ' A' ' 36' ' ' ALA . 3.4 pp . . . . . 0 C--O 1.23 0.029 0 CA-C-O 120.891 0.377 . . . . 0.0 111.027 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.47 -38.3 53.14 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.734 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.44 -29.12 20.43 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.783 179.691 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.67 -37.05 85.87 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.198 179.466 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.586 ' HB3' HG11 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -85.27 -37.81 19.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.75 179.54 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.48 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -56.97 -46.73 81.98 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 179.101 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.404 ' N ' ' HG3' ' A' ' 14' ' ' GLU . 6.8 tp10 -66.42 -36.06 81.86 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 177.952 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.532 ' HA ' ' HG3' ' A' ' 46' ' ' LYS . . . -64.22 -39.76 94.64 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 115.147 -0.933 . . . . 0.0 110.193 179.368 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.727 HD13 HG12 ' A' ' 30' ' ' ILE . 25.7 mm -54.39 -46.91 70.29 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.167 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 178.57 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 24.3 mmtm -62.01 -33.23 73.95 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.717 178.366 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.547 ' HG3' HD13 ' A' ' 50' ' ' LEU . 0.5 OUTLIER -62.04 -52.53 63.59 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.613 179.55 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.704 HD22 ' HB ' ' A' ' 30' ' ' ILE . 0.2 OUTLIER -76.86 -34.4 57.82 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.942 -179.818 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.708 HG23 ' O ' ' A' ' 17' ' ' ILE . 52.8 t -63.08 -31.24 51.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 120.866 0.365 . . . . 0.0 110.188 179.535 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -90.26 -35.37 15.34 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.6 179.513 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.415 ' O ' ' O ' ' A' ' 24' ' ' GLY . . . -79.02 -15.26 58.48 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.4 179.732 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.872 ' O ' HG23 ' A' ' 25' ' ' ILE . . . 44.37 105.9 0.01 OUTLIER Glycine 0 CA--C 1.526 0.758 0 N-CA-C 114.243 0.457 . . . . 0.0 114.243 179.009 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.872 HG23 ' O ' ' A' ' 24' ' ' GLY . 1.7 pp -176.41 -170.86 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 CA-C-N 116.823 0.312 . . . . 0.0 110.556 178.646 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -35.91 94.97 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.325 0 N-CA-C 112.225 0.454 . . . . 0.0 112.225 -179.387 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.618 ' O ' HG22 ' A' ' 30' ' ' ILE . 4.7 pt-20 -54.55 -25.38 25.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.67 179.572 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -43.08 -47.68 6.06 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.928 179.457 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.669 ' HA ' ' HG ' ' A' ' 32' ' ' LEU . 3.4 m-85 -63.12 -32.75 74.21 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.292 0.568 . . . . 0.0 110.092 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.727 HG12 HD13 ' A' ' 17' ' ' ILE . 1.4 tt -59.71 -26.27 34.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.67 178.295 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.5 tppp? -76.83 -37.06 56.36 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.637 179.583 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.896 ' HB2' HD23 ' A' ' 45' ' ' LEU . 0.2 OUTLIER -58.95 -34.06 71.32 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 120.299 -0.56 . . . . 0.0 109.802 179.379 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.607 HG22 ' HA ' ' A' ' 42' ' ' VAL . 3.0 pt -91.68 -45.88 14.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.882 179.378 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.513 ' HB2' HD11 ' A' ' 17' ' ' ILE . . . -57.99 -28.89 64.8 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.747 179.961 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 11.0 t-20 -88.05 -15.99 34.83 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.079 179.894 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.77 ' HB1' HD13 ' A' ' 9' ' ' LEU . . . 60.31 -137.84 0.65 Allowed 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.985 179.596 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.516 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 2.9 tppt? 93.69 -26.0 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 122.753 0.421 . . . . 0.0 110.87 -179.523 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.676 ' O ' HG23 ' A' ' 42' ' ' VAL . 10.2 m -142.55 81.61 1.74 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.401 179.566 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.506 HG13 ' N ' ' A' ' 40' ' ' GLU . 12.3 p -41.95 -47.32 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.349 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.588 -179.693 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.506 ' N ' HG13 ' A' ' 39' ' ' VAL . 0.1 OUTLIER -60.27 -42.43 95.4 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 179.3 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.6 ' H ' HG22 ' A' ' 38' ' ' THR . . . -69.85 -47.59 46.59 Favored Glycine 0 N--CA 1.448 -0.546 0 C-N-CA 120.506 -0.854 . . . . 0.0 111.949 178.86 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.676 HG23 ' O ' ' A' ' 38' ' ' THR . 17.0 t -43.14 -41.97 1.24 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.163 0 CA-C-O 121.134 0.492 . . . . 0.0 110.548 179.239 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 2.6 t-105 -77.17 -32.65 56.34 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.762 -0.653 . . . . 0.0 111.02 179.325 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.7 m -80.52 -52.14 7.96 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 120.815 0.341 . . . . 0.0 111.072 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.896 HD23 ' HB2' ' A' ' 32' ' ' LEU . 0.4 OUTLIER -53.64 -34.2 57.76 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.922 179.445 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.532 ' HG3' ' HA ' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -69.17 -60.64 2.21 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.02 179.233 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -57.76 -30.82 65.93 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.169 179.659 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -77.01 -52.74 8.82 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.103 179.701 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.73 HG22 ' O ' ' A' ' 45' ' ' LEU . 4.9 tp -57.12 -24.09 20.0 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.22 0 C-N-CA 120.589 -0.444 . . . . 0.0 111.054 -179.846 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.547 HD13 ' HG3' ' A' ' 19' ' ' GLU . 1.5 tp -80.09 -35.14 37.32 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 178.735 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 50.2 m -57.68 -27.85 63.26 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.74 178.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.555 ' C ' ' CD1' ' A' ' 52' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.531 0.225 0 CA-C-O 120.782 0.325 . . . . 0.0 110.918 179.636 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.788 ' HG ' HG21 ' A' ' 42' ' ' VAL . 4.6 tt . . . . . 0 N--CA 1.451 -0.379 0 CA-C-O 120.843 0.354 . . . . 0.0 111.18 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -54.5 -36.67 64.45 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.51 179.769 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -87.04 -32.33 20.05 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.381 179.511 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.64 -37.24 78.14 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.481 179.408 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.624 ' HB3' HG11 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -85.1 -36.65 21.0 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.478 179.593 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.478 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 1.9 mm-40 -58.39 -50.39 73.86 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 178.949 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 56.5 tt0 -63.36 -34.55 77.97 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 177.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.564 ' CB ' HD12 ' A' ' 33' ' ' ILE . . . -63.57 -36.39 83.64 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 115.153 -0.93 . . . . 0.0 110.173 179.239 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.787 ' O ' HG23 ' A' ' 21' ' ' VAL . 20.4 mm -57.75 -49.17 81.73 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.139 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 178.762 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 20.4 mmtt -61.3 -33.14 73.08 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.97 178.651 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.594 ' HG3' HD13 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -59.01 -52.45 65.72 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.622 179.56 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.66 HD21 ' O ' ' A' ' 25' ' ' ILE . 0.2 OUTLIER -76.16 -29.81 57.87 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.537 179.772 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.787 HG23 ' O ' ' A' ' 17' ' ' ILE . 66.5 t -67.54 -31.2 51.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.959 0.409 . . . . 0.0 110.095 179.355 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -90.22 -33.84 16.03 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.191 179.423 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -84.66 -15.01 46.87 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.2 179.466 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.732 ' O ' HG23 ' A' ' 25' ' ' ILE . . . 40.4 86.19 0.01 OUTLIER Glycine 0 C--N 1.334 0.444 0 CA-C-N 116.299 -0.409 . . . . 0.0 113.645 179.576 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.732 HG23 ' O ' ' A' ' 24' ' ' GLY . 1.2 pp -172.66 138.54 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 CA-C-O 121.058 0.456 . . . . 0.0 112.033 179.53 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . 35.82 86.83 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 115.575 -0.739 . . . . 0.0 112.75 179.769 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.677 ' O ' HG22 ' A' ' 30' ' ' ILE . 1.3 mt-10 -61.66 -28.58 69.49 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.164 0.507 . . . . 0.0 109.669 178.606 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -45.92 -45.8 15.66 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.639 179.06 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.624 ' HA ' ' HG ' ' A' ' 32' ' ' LEU . 3.4 m-85 -65.58 -30.07 70.75 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.156 0.503 . . . . 0.0 110.284 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.677 HG22 ' O ' ' A' ' 27' ' ' GLU . 1.9 tt -61.8 -26.21 39.19 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 178.079 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.2 tppp? -76.33 -38.06 56.48 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.676 179.588 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.624 ' HG ' ' HA ' ' A' ' 29' ' ' TYR . 0.1 OUTLIER -59.72 -33.57 71.8 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 120.117 -0.633 . . . . 0.0 109.92 179.445 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.564 HD12 ' CB ' ' A' ' 16' ' ' ALA . 4.7 pt -90.18 -48.41 14.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.795 179.397 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -56.28 -28.07 57.48 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.95 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 20.9 t30 -91.54 -15.57 28.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.159 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.725 ' CB ' HD21 ' A' ' 9' ' ' LEU . . . 60.58 -162.81 0.26 Allowed 'General case' 0 C--N 1.333 -0.11 0 CA-C-O 120.499 0.19 . . . . 0.0 111.005 179.673 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.564 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 6.3 tttt 138.14 -52.97 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 123.786 0.834 . . . . 0.0 109.081 -179.478 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.66 ' O ' HG23 ' A' ' 42' ' ' VAL . 1.0 OUTLIER -129.24 101.74 6.14 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.333 -0.849 . . . . 0.0 109.847 178.946 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.542 ' N ' HD12 ' A' ' 9' ' ' LEU . 10.4 p -42.39 -38.09 0.77 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.326 0 CA-C-O 121.301 0.572 . . . . 0.0 110.81 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -69.84 -44.99 68.77 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.469 -0.787 . . . . 0.0 109.701 179.239 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -63.75 -45.16 95.08 Favored Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 120.349 -0.929 . . . . 0.0 111.335 178.745 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.788 HG21 ' HG ' ' A' ' 9' ' ' LEU . 11.7 t -48.18 -41.84 10.57 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-O 121.194 0.521 . . . . 0.0 110.008 178.919 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 48.2 t90 -77.34 -27.81 52.85 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.529 -0.76 . . . . 0.0 111.097 179.379 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.8 m -80.8 -48.84 11.9 Favored 'General case' 0 C--N 1.334 -0.107 0 CA-C-O 120.814 0.34 . . . . 0.0 111.035 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.731 ' O ' HG22 ' A' ' 49' ' ' ILE . 4.0 mm? -58.61 -34.75 71.49 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.103 179.56 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.456 ' HD2' ' HB2' ' A' ' 16' ' ' ALA . 12.2 tttm -68.46 -59.89 2.83 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.63 -0.713 . . . . 0.0 110.305 179.379 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -58.47 -31.03 67.44 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.361 179.681 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -77.1 -53.12 8.18 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.835 -0.621 . . . . 0.0 111.081 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.731 HG22 ' O ' ' A' ' 45' ' ' LEU . 4.6 tp -57.49 -23.91 20.77 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.143 0 C-N-CA 120.824 -0.35 . . . . 0.0 111.179 -179.872 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.594 HD13 ' HG3' ' A' ' 19' ' ' GLU . 2.0 tp -81.69 -32.34 31.75 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.692 -0.484 . . . . 0.0 109.692 178.782 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 17.0 m -64.79 -23.74 67.34 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.706 179.767 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.602 ' CD1' HD12 ' A' ' 49' ' ' ILE . 0.0 OUTLIER . . . . . 0 N--CA 1.464 0.263 0 CA-C-O 121.245 0.545 . . . . 0.0 111.351 179.871 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.726 HD21 ' CB ' ' A' ' 36' ' ' ALA . 6.5 tt . . . . . 0 N--CA 1.45 -0.438 0 CA-C-O 120.825 0.345 . . . . 0.0 111.43 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 4.9 mtpt -52.92 -37.79 61.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.8 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -87.52 -29.13 21.56 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.861 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.58 -36.62 84.39 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.196 179.497 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.699 ' O ' HD13 ' A' ' 17' ' ' ILE . 0.0 OUTLIER -85.27 -36.38 20.92 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.903 179.549 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.462 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 5.4 pt-20 -59.87 -50.11 75.08 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 179.159 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.443 ' N ' ' CG ' ' A' ' 14' ' ' GLU . 1.1 tp10 -65.0 -36.32 84.04 Favored 'General case' 0 CA--C 1.516 -0.345 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 178.183 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.458 ' HB1' HD13 ' A' ' 33' ' ' ILE . . . -64.45 -34.29 77.86 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 115.234 -0.893 . . . . 0.0 110.308 179.461 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.751 ' O ' HG23 ' A' ' 21' ' ' VAL . 1.3 mp -59.81 -45.83 94.37 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.277 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 178.808 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 11.3 mttt -65.46 -33.07 75.09 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.56 -0.746 . . . . 0.0 109.966 178.629 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.597 ' HG3' HD13 ' A' ' 50' ' ' LEU . 0.5 OUTLIER -56.88 -52.58 64.57 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.315 179.996 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.883 HD22 HG13 ' A' ' 30' ' ' ILE . 0.2 OUTLIER -77.63 -32.76 53.63 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.768 0.318 . . . . 0.0 110.711 -179.859 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.751 HG23 ' O ' ' A' ' 17' ' ' ILE . 55.6 t -62.82 -31.39 52.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-O 120.87 0.367 . . . . 0.0 110.203 179.464 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -90.82 -36.98 13.91 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.2 179.368 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -77.07 -14.92 59.75 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.072 179.367 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.408 ' N ' ' O ' ' A' ' 20' ' ' LEU . . . 49.71 100.99 0.01 OUTLIER Glycine 0 CA--C 1.523 0.533 0 C-N-CA 121.185 -0.531 . . . . 0.0 113.274 179.447 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.564 HG21 ' CE1' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -168.84 -169.55 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.253 0 CA-C-N 117.029 0.415 . . . . 0.0 111.403 179.345 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -43.24 95.33 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.006 -0.543 . . . . 0.0 112.143 -179.401 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.415 ' O ' ' N ' ' A' ' 30' ' ' ILE . 0.6 OUTLIER -52.61 -25.9 11.97 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.292 0.568 . . . . 0.0 110.513 179.107 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.4 ' O ' ' HB3' ' A' ' 31' ' ' LYS . 1.9 tptm -46.3 -44.91 17.01 Favored 'General case' 0 C--O 1.238 0.493 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.168 179.067 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.79 ' CG ' HD13 ' A' ' 49' ' ' ILE . 2.7 m-85 -61.46 -31.8 71.78 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.003 179.72 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.883 HG13 HD22 ' A' ' 20' ' ' LEU . 43.6 mt -60.65 -26.47 38.06 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.331 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 177.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.4 ' HB3' ' O ' ' A' ' 28' ' ' LYS . 0.1 OUTLIER -74.98 -37.32 61.94 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.694 179.429 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.607 ' HG ' ' HA ' ' A' ' 29' ' ' TYR . 0.1 OUTLIER -60.52 -33.37 72.55 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 120.03 -0.668 . . . . 0.0 109.841 179.55 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.636 HG22 ' HA ' ' A' ' 42' ' ' VAL . 3.7 pt -91.72 -46.69 14.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.987 179.619 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.447 ' HB2' HD11 ' A' ' 17' ' ' ILE . . . -58.71 -29.51 66.73 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.741 -179.949 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 -85.06 -12.91 51.96 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.921 179.841 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.726 ' CB ' HD21 ' A' ' 9' ' ' LEU . . . 58.59 -139.9 0.76 Allowed 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 116.656 -0.247 . . . . 0.0 110.97 179.445 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.545 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 0.4 OUTLIER 95.68 -27.12 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 122.797 0.439 . . . . 0.0 110.796 -179.855 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.707 ' O ' HG23 ' A' ' 42' ' ' VAL . 55.5 p -143.65 83.14 1.75 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.624 179.671 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.644 ' CA ' HD12 ' A' ' 9' ' ' LEU . 8.1 p -40.63 -48.85 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.494 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.531 ' N ' HG13 ' A' ' 39' ' ' VAL . 30.0 mm-40 -61.58 -41.45 97.43 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.283 -0.417 . . . . 0.0 109.957 179.61 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -68.03 -47.12 61.56 Favored Glycine 0 N--CA 1.448 -0.555 0 C-N-CA 120.519 -0.848 . . . . 0.0 111.788 178.733 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.707 HG23 ' O ' ' A' ' 38' ' ' THR . 11.9 t -43.8 -41.9 1.65 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.164 0 CA-C-O 121.276 0.56 . . . . 0.0 110.254 179.026 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 73.7 t-105 -78.3 -31.26 48.76 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.549 -0.751 . . . . 0.0 111.304 179.333 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.9 m -79.12 -49.2 12.98 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.84 0.352 . . . . 0.0 110.959 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.687 ' O ' HG22 ' A' ' 49' ' ' ILE . 1.8 mt -56.88 -34.9 68.32 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.064 -0.516 . . . . 0.0 109.928 179.459 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.447 ' HB2' ' CB ' ' A' ' 16' ' ' ALA . 12.8 tttm -67.87 -59.82 2.99 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.479 179.486 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.74 -32.64 69.41 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.497 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -76.19 -53.65 7.96 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.918 179.885 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.79 HD13 ' CG ' ' A' ' 29' ' ' TYR . 9.1 tp -58.41 -24.4 24.85 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.152 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.162 -179.73 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.597 HD13 ' HG3' ' A' ' 19' ' ' GLU . 4.1 tp -78.87 -34.54 44.86 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 178.753 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 35.6 m -58.35 -34.82 71.07 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.913 179.354 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.794 ' CG ' ' O ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.541 0.613 0 CA-C-O 121.577 0.703 . . . . 0.0 110.76 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.744 HD21 ' CB ' ' A' ' 36' ' ' ALA . 4.0 tt . . . . . 0 N--CA 1.451 -0.382 0 CA-C-O 120.862 0.363 . . . . 0.0 110.643 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.454 ' N ' HD23 ' A' ' 9' ' ' LEU . 3.7 mtmp? -54.18 -32.68 56.18 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.562 179.641 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.429 ' O ' ' HG2' ' A' ' 14' ' ' GLU . 0.8 OUTLIER -87.7 -32.94 18.93 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.55 179.551 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.62 -36.75 76.95 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.269 179.368 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.637 ' HB3' HG11 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -85.04 -37.99 19.71 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.592 179.406 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.489 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 4.5 pt-20 -56.36 -49.56 74.07 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 178.902 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.424 ' N ' ' CG ' ' A' ' 14' ' ' GLU . 60.4 tt0 -63.38 -34.01 76.8 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 177.64 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.605 ' HB1' ' CD1' ' A' ' 33' ' ' ILE . . . -63.71 -39.53 94.52 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 115.143 -0.935 . . . . 0.0 109.968 179.073 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.773 ' O ' HG23 ' A' ' 21' ' ' VAL . 28.8 mm -55.61 -49.69 72.12 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.2 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 178.523 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.6 -32.15 70.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.304 -0.862 . . . . 0.0 109.695 178.399 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.648 ' CG ' HD13 ' A' ' 50' ' ' LEU . 0.2 OUTLIER -65.97 -52.47 49.29 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.637 179.533 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.733 HD22 ' HB ' ' A' ' 30' ' ' ILE . 0.3 OUTLIER -71.74 -32.97 68.31 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.392 179.768 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.773 HG23 ' O ' ' A' ' 17' ' ' ILE . 65.4 t -63.87 -31.44 53.18 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.207 0 CA-C-N 116.311 -0.404 . . . . 0.0 109.973 179.113 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -85.19 -38.4 19.03 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.946 179.199 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.754 ' CB ' HD11 ' A' ' 25' ' ' ILE . . . -76.1 -15.09 60.16 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.968 179.267 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.412 ' C ' HG13 ' A' ' 25' ' ' ILE . . . 39.81 89.8 0.01 OUTLIER Glycine 0 CA--C 1.523 0.552 0 CA-C-N 116.144 -0.48 . . . . 0.0 114.243 179.019 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.754 HD11 ' CB ' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -153.43 -167.65 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.268 0 CA-C-N 116.78 0.29 . . . . 0.0 110.702 179.028 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.446 ' HB3' ' CE2' ' A' ' 29' ' ' TYR . . . -46.65 97.22 0.01 OUTLIER 'General case' 0 C--O 1.232 0.149 0 CA-C-O 120.927 0.394 . . . . 0.0 111.344 -179.6 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.588 ' O ' HG22 ' A' ' 30' ' ' ILE . 0.2 OUTLIER -45.28 -25.43 0.38 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.268 179.574 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -40.95 -48.23 3.13 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 121.436 0.636 . . . . 0.0 110.839 179.463 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.594 ' HA ' ' HG ' ' A' ' 32' ' ' LEU . 58.1 m-85 -60.63 -33.65 73.09 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.14 179.87 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.733 ' HB ' HD22 ' A' ' 20' ' ' LEU . 1.8 tt -60.39 -26.29 36.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.641 -0.709 . . . . 0.0 109.676 178.392 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.32 -36.88 58.07 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.761 179.598 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.617 HD12 HD12 ' A' ' 45' ' ' LEU . 0.1 OUTLIER -58.88 -33.9 71.03 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 120.229 -0.588 . . . . 0.0 109.634 179.315 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.605 ' CD1' ' HB1' ' A' ' 16' ' ' ALA . 2.5 pt -91.75 -46.43 14.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.723 179.266 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -58.44 -29.5 66.18 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.757 -179.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 25.6 t30 -84.95 -16.32 41.39 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.015 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.744 ' CB ' HD21 ' A' ' 9' ' ' LEU . . . 59.07 -136.93 0.81 Allowed 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.137 179.505 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.539 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 25.0 tttt 95.29 -27.32 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 122.851 0.46 . . . . 0.0 110.667 -179.478 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.66 ' O ' HG23 ' A' ' 42' ' ' VAL . 60.1 p -142.25 83.68 1.84 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.332 179.522 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.533 HG13 ' N ' ' A' ' 40' ' ' GLU . 8.6 p -39.57 -49.45 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.566 -179.726 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.533 ' N ' HG13 ' A' ' 39' ' ' VAL . 0.1 OUTLIER -61.62 -43.17 99.35 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.873 -0.418 . . . . 0.0 109.873 179.289 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -65.75 -46.13 84.94 Favored Glycine 0 N--CA 1.447 -0.568 0 C-N-CA 120.447 -0.883 . . . . 0.0 111.724 178.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.66 HG23 ' O ' ' A' ' 38' ' ' THR . 14.6 t -45.44 -41.6 3.09 Favored 'Isoleucine or valine' 0 C--O 1.233 0.217 0 CA-C-O 121.126 0.489 . . . . 0.0 110.261 179.048 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 69.1 t90 -77.2 -30.57 54.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.0 179.382 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.4 m -79.39 -49.15 12.8 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 120.804 0.335 . . . . 0.0 110.91 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.759 ' O ' HG22 ' A' ' 49' ' ' ILE . 3.5 mm? -56.78 -36.03 69.38 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.239 179.4 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.521 ' HD3' ' HB2' ' A' ' 16' ' ' ALA . 15.5 ttpp -67.83 -58.85 3.89 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.604 179.523 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.48 -32.37 68.7 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.293 179.789 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 17.1 tt0 -77.22 -53.52 7.63 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.981 179.815 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.759 HG22 ' O ' ' A' ' 45' ' ' LEU . 3.6 tp -56.61 -23.97 18.26 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.289 0 C-N-CA 120.902 -0.319 . . . . 0.0 111.217 -179.773 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.648 HD13 ' CG ' ' A' ' 19' ' ' GLU . 1.8 tp -81.65 -33.32 31.41 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 178.766 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 17.1 m -64.43 -18.52 64.81 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.66 179.41 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.574 ' CD1' ' O ' ' A' ' 49' ' ' ILE . 0.0 OUTLIER . . . . . 0 CA--C 1.531 0.223 0 CA-C-O 121.338 0.589 . . . . 0.0 111.361 -179.709 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.728 HD21 ' CB ' ' A' ' 36' ' ' ALA . 6.8 tt . . . . . 0 N--CA 1.451 -0.406 0 CA-C-O 120.941 0.4 . . . . 0.0 111.118 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.425 ' HA ' ' HD3' ' A' ' 13' ' ' LYS . 45.9 tttp -52.79 -35.34 56.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.901 179.874 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.406 ' O ' ' HG3' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -87.37 -32.85 19.37 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.62 179.825 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.91 -37.99 77.91 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.314 179.344 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.664 ' HB3' HG11 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -85.38 -35.4 21.38 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.784 -0.643 . . . . 0.0 111.021 179.754 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.619 ' O ' HG22 ' A' ' 17' ' ' ILE . 0.3 OUTLIER -58.52 -42.18 87.12 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 121.505 0.669 . . . . 0.0 109.299 179.086 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -72.75 -31.1 64.67 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.311 -0.859 . . . . 0.0 108.89 177.864 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.691 ' HB1' ' CD1' ' A' ' 33' ' ' ILE . . . -69.63 -42.44 74.32 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.184 -0.917 . . . . 0.0 111.335 179.903 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.683 ' O ' HG23 ' A' ' 21' ' ' VAL . 2.2 tp -61.6 -37.35 77.69 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.243 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 179.085 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.64 -32.46 71.16 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 177.491 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.59 ' CG ' HD13 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -62.03 -52.68 63.0 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.999 179.479 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.506 ' HG ' HG13 ' A' ' 25' ' ' ILE . 0.2 OUTLIER -74.95 -35.02 62.13 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.133 -179.442 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.683 HG23 ' O ' ' A' ' 17' ' ' ILE . 41.8 t -63.58 -31.25 52.24 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-O 120.838 0.351 . . . . 0.0 110.284 179.493 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -91.69 -33.12 15.18 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.638 179.571 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.419 ' O ' ' O ' ' A' ' 24' ' ' GLY . . . -82.48 -15.05 53.91 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.579 179.858 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.714 ' O ' HG23 ' A' ' 25' ' ' ILE . . . 48.76 105.02 0.01 OUTLIER Glycine 0 CA--C 1.524 0.643 0 C-N-CA 121.136 -0.554 . . . . 0.0 113.104 179.607 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.714 HG23 ' O ' ' A' ' 24' ' ' GLY . 0.7 OUTLIER -177.43 -173.67 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.199 0 CA-C-N 117.213 0.506 . . . . 0.0 111.709 179.715 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -37.03 95.15 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 115.964 -0.562 . . . . 0.0 112.358 -179.15 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.438 ' O ' ' N ' ' A' ' 30' ' ' ILE . 9.8 tt0 -54.92 -25.36 28.76 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.559 179.143 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.8 tptm -44.63 -47.94 10.46 Favored 'General case' 0 C--O 1.239 0.51 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.699 179.389 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.611 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 2.7 m-85 -64.34 -30.39 71.44 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.278 0.561 . . . . 0.0 109.855 179.582 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.63 ' CD1' HD12 ' A' ' 17' ' ' ILE . 0.6 OUTLIER -61.58 -26.4 39.51 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 CA-C-N 115.846 -0.615 . . . . 0.0 109.402 178.056 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -75.88 -38.06 58.25 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.73 179.524 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.735 ' HB2' HD13 ' A' ' 45' ' ' LEU . 0.0 OUTLIER -61.02 -32.0 71.61 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 119.962 -0.695 . . . . 0.0 109.876 179.528 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.691 ' CD1' ' HB1' ' A' ' 16' ' ' ALA . 4.1 pt -91.7 -46.47 14.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.986 179.334 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -58.74 -29.03 66.41 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.807 -179.735 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -89.15 -16.43 31.42 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.963 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.728 ' CB ' HD21 ' A' ' 9' ' ' LEU . . . 62.52 -139.98 0.42 Allowed 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 116.682 -0.236 . . . . 0.0 111.007 179.603 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.537 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 0.0 OUTLIER 95.83 -27.63 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 122.818 0.447 . . . . 0.0 110.712 -179.73 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.692 ' O ' HG23 ' A' ' 42' ' ' VAL . 0.2 OUTLIER -140.88 83.14 1.87 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.435 179.618 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.52 HG13 ' N ' ' A' ' 40' ' ' GLU . 9.2 p -40.93 -48.64 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.4 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.501 -179.849 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.52 ' N ' HG13 ' A' ' 39' ' ' VAL . 0.6 OUTLIER -62.11 -41.11 97.89 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 179.533 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -67.7 -47.11 63.43 Favored Glycine 0 N--CA 1.448 -0.511 0 C-N-CA 120.483 -0.865 . . . . 0.0 111.84 178.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.692 HG23 ' O ' ' A' ' 38' ' ' THR . 7.4 t -45.12 -40.43 2.32 Favored 'Isoleucine or valine' 0 C--O 1.232 0.139 0 CA-C-O 121.23 0.538 . . . . 0.0 110.198 179.161 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 60.8 t-105 -77.98 -31.52 50.8 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.985 179.186 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.8 m -78.66 -53.7 6.89 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.867 0.365 . . . . 0.0 110.988 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.737 ' O ' HG22 ' A' ' 49' ' ' ILE . 3.3 mt -55.14 -34.47 63.79 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.307 179.66 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.434 ' HB2' ' HB2' ' A' ' 16' ' ' ALA . 4.9 tttm -67.48 -58.64 4.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.229 179.446 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -60.5 -30.16 69.54 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.392 179.792 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -78.5 -53.15 7.53 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.109 179.847 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.737 HG22 ' O ' ' A' ' 45' ' ' LEU . 4.4 tp -55.69 -24.14 15.96 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.122 0 C-N-CA 120.961 -0.296 . . . . 0.0 110.912 -179.906 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.59 HD13 ' CG ' ' A' ' 19' ' ' GLU . 0.7 OUTLIER -82.39 -33.45 28.71 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 178.523 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 24.2 m -59.21 -24.93 63.56 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.13 179.172 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.579 ' CG ' ' O ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.535 0.378 0 CA-C-O 121.139 0.495 . . . . 0.0 111.078 179.94 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.718 HD21 ' CB ' ' A' ' 36' ' ' ALA . 8.9 tt . . . . . 0 N--CA 1.456 -0.132 0 CA-C-O 121.003 0.43 . . . . 0.0 111.272 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.471 ' HA ' ' HD3' ' A' ' 13' ' ' LYS . 1.3 ttpp -52.89 -35.32 57.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.957 -179.852 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.89 -29.15 19.84 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.872 -179.988 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.34 -37.59 87.87 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.143 179.374 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.573 ' HB3' HG11 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -85.42 -35.49 21.26 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.96 179.712 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.799 ' O ' HG22 ' A' ' 17' ' ' ILE . 0.3 OUTLIER -60.03 -44.91 94.3 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.43 0.633 . . . . 0.0 109.312 179.206 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.4 ' N ' ' HG3' ' A' ' 14' ' ' GLU . 0.9 OUTLIER -70.18 -31.05 68.34 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.531 -0.758 . . . . 0.0 109.05 177.967 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.567 ' HB1' ' CD1' ' A' ' 33' ' ' ILE . . . -71.19 -38.32 72.09 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.221 -0.9 . . . . 0.0 111.329 -179.886 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.799 HG22 ' O ' ' A' ' 14' ' ' GLU . 1.7 tp -63.51 -34.87 70.13 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.289 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 179.338 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.5 mmmp? -72.26 -32.32 66.55 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 109.082 -0.71 . . . . 0.0 109.082 177.667 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.511 ' HB3' HD13 ' A' ' 50' ' ' LEU . 0.5 OUTLIER -63.77 -52.72 59.08 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.22 -0.9 . . . . 0.0 111.076 179.745 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.704 HD22 ' HB ' ' A' ' 30' ' ' ILE . 0.2 OUTLIER -73.93 -35.82 64.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.212 -179.52 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.626 HG23 ' O ' ' A' ' 17' ' ' ILE . 33.0 t -63.29 -31.17 51.79 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-O 120.833 0.349 . . . . 0.0 110.32 179.552 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -90.04 -34.08 16.08 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.506 179.605 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.449 ' HB3' HD11 ' A' ' 25' ' ' ILE . . . -80.23 -15.12 57.71 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.534 179.723 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.597 ' O ' HG23 ' A' ' 25' ' ' ILE . . . 46.09 94.81 0.01 OUTLIER Glycine 0 CA--C 1.522 0.471 0 C-N-CA 121.001 -0.619 . . . . 0.0 113.237 179.724 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.738 ' N ' HD13 ' A' ' 25' ' ' ILE . 0.1 OUTLIER -160.63 -172.15 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.333 -0.13 0 CA-C-N 116.752 0.276 . . . . 0.0 111.239 179.87 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -41.47 94.75 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.948 -179.607 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.567 ' O ' HG22 ' A' ' 30' ' ' ILE . 0.0 OUTLIER -50.88 -25.61 4.76 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.623 179.59 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -45.89 -46.95 16.17 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-O 121.303 0.573 . . . . 0.0 110.548 179.195 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.68 ' HA ' ' HG ' ' A' ' 32' ' ' LEU . 3.0 m-85 -64.19 -29.78 70.87 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.279 0.562 . . . . 0.0 109.895 179.688 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.704 ' HB ' HD22 ' A' ' 20' ' ' LEU . 1.0 OUTLIER -62.38 -26.44 40.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.379 177.934 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -75.3 -36.05 61.19 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.403 179.373 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.68 ' HG ' ' HA ' ' A' ' 29' ' ' TYR . 0.2 OUTLIER -60.4 -34.66 74.24 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 120.263 -0.575 . . . . 0.0 109.826 179.146 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.567 ' CD1' ' HB1' ' A' ' 16' ' ' ALA . 5.5 pt -89.99 -46.33 15.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.943 179.414 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -61.11 -29.62 69.87 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.952 -179.46 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 33.1 t30 -84.99 -20.84 29.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.017 179.9 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.718 ' CB ' HD21 ' A' ' 9' ' ' LEU . . . 63.37 -140.01 0.35 Allowed 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.976 179.609 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.495 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 1.5 tpmp? 90.14 -22.38 0.11 Allowed 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 122.607 0.363 . . . . 0.0 111.221 -179.76 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.715 ' O ' HG23 ' A' ' 42' ' ' VAL . 0.8 OUTLIER -143.37 79.03 1.62 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.586 -0.279 . . . . 0.0 110.617 179.611 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.621 ' CA ' HD12 ' A' ' 9' ' ' LEU . 11.6 p -38.8 -49.05 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.445 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.767 -179.681 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.531 ' N ' HG13 ' A' ' 39' ' ' VAL . 0.2 OUTLIER -59.72 -47.53 85.27 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 179.511 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.47 ' O ' HD23 ' A' ' 45' ' ' LEU . . . -66.62 -40.25 94.02 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.412 -0.899 . . . . 0.0 112.452 179.269 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.715 HG23 ' O ' ' A' ' 38' ' ' THR . 21.4 t -47.07 -48.65 8.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 117.114 0.457 . . . . 0.0 110.56 179.627 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.467 ' CD1' ' HA ' ' A' ' 40' ' ' GLU . 15.4 p-90 -77.27 -26.16 52.15 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.444 179.617 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.8 m -79.68 -42.16 25.33 Favored 'General case' 0 N--CA 1.462 0.167 0 C-N-CA 120.599 -0.44 . . . . 0.0 110.983 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.725 ' O ' HG22 ' A' ' 49' ' ' ILE . 3.8 mm? -62.64 -33.77 75.71 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.133 -0.485 . . . . 0.0 109.846 179.405 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.463 ' HA ' HG22 ' A' ' 49' ' ' ILE . 8.6 ttpt -68.89 -62.12 1.52 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.229 179.292 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -55.7 -28.79 57.58 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.343 179.752 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -80.03 -54.72 5.52 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-N 115.828 -0.623 . . . . 0.0 110.713 179.589 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.725 HG22 ' O ' ' A' ' 45' ' ' LEU . 7.0 tp -58.69 -23.99 24.68 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.187 0 CA-C-O 120.86 0.362 . . . . 0.0 110.856 179.839 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.511 HD13 ' HB3' ' A' ' 19' ' ' GLU . 2.3 tp -80.3 -33.42 37.61 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.268 -0.642 . . . . 0.0 109.268 178.375 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 29.3 m -58.21 -29.71 65.91 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.783 179.085 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.627 ' HD1' ' O ' ' A' ' 49' ' ' ILE . 0.0 OUTLIER . . . . . 0 CA--C 1.535 0.384 0 CA-C-O 120.89 0.376 . . . . 0.0 111.037 179.576 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 1.057 HD23 HG21 ' A' ' 42' ' ' VAL . 0.1 OUTLIER . . . . . 0 N--CA 1.453 -0.307 0 CA-C-O 121.056 0.455 . . . . 0.0 110.696 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.817 ' N ' HD13 ' A' ' 9' ' ' LEU . 0.0 OUTLIER -56.82 -35.29 68.61 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.017 -179.969 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.3 -38.07 16.6 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.937 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.37 -37.42 70.04 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.645 179.623 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.666 ' HB3' HG11 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -85.19 -35.38 21.69 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.679 179.587 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.454 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 3.0 mm-40 -59.44 -50.43 73.97 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 179.059 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -63.77 -36.83 85.19 Favored 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 108.925 -0.768 . . . . 0.0 108.925 178.033 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.541 ' HB1' HD13 ' A' ' 33' ' ' ILE . . . -64.21 -35.04 79.5 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-N 115.092 -0.958 . . . . 0.0 110.346 179.483 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.82 ' O ' HG23 ' A' ' 21' ' ' VAL . 1.4 mp -58.62 -47.44 88.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 178.965 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 4.6 mmmt -63.13 -33.12 74.77 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.936 178.59 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.611 ' HB3' HD13 ' A' ' 50' ' ' LEU . 0.2 OUTLIER -57.77 -52.49 65.25 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.873 179.618 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.956 HD22 HG13 ' A' ' 30' ' ' ILE . 0.2 OUTLIER -76.06 -30.63 58.44 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.703 -0.399 . . . . 0.0 110.37 179.77 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.82 HG23 ' O ' ' A' ' 17' ' ' ILE . 53.1 t -62.76 -31.28 51.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 178.733 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -86.91 -39.89 15.34 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.878 178.975 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.804 ' CB ' HD11 ' A' ' 25' ' ' ILE . . . -73.91 -15.05 61.15 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.795 179.033 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.424 ' C ' HG13 ' A' ' 25' ' ' ILE . . . 43.48 77.69 0.08 OUTLIER Glycine 0 C--N 1.333 0.396 0 CA-C-N 116.013 -0.539 . . . . 0.0 114.224 179.136 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.804 HD11 ' CB ' ' A' ' 23' ' ' ALA . 0.2 OUTLIER -141.83 -171.74 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.246 0 CA-C-O 120.734 0.302 . . . . 0.0 110.785 178.745 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.536 ' H ' HG22 ' A' ' 25' ' ' ILE . . . -44.57 97.64 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.676 -179.477 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.489 ' O ' ' N ' ' A' ' 30' ' ' ILE . 10.5 pt-20 -45.85 -25.23 0.49 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.16 179.187 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -41.29 -47.61 3.47 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 121.45 0.643 . . . . 0.0 110.8 179.456 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.594 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 63.3 m-85 -59.3 -32.39 70.01 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.336 179.909 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.956 HG13 HD22 ' A' ' 20' ' ' LEU . 25.8 mt -62.21 -26.64 40.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.464 177.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 6.3 tttm -74.29 -36.1 63.75 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.61 179.662 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.594 ' HG ' ' O ' ' A' ' 29' ' ' TYR . 0.1 OUTLIER -61.51 -33.97 74.71 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 120.216 -0.594 . . . . 0.0 109.815 179.353 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.552 HG22 ' HA ' ' A' ' 42' ' ' VAL . 2.4 pt -91.91 -44.71 14.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.046 179.408 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.421 ' CB ' ' O ' ' A' ' 30' ' ' ILE . . . -61.1 -30.99 70.69 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.079 -179.651 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 23.6 t30 -81.57 -3.05 52.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.114 -179.858 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.78 ' CB ' HD21 ' A' ' 9' ' ' LEU . . . 49.92 -131.04 1.95 Allowed 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 116.549 -0.296 . . . . 0.0 111.242 179.465 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.416 ' HB2' ' O ' ' A' ' 36' ' ' ALA . 0.0 OUTLIER 76.16 -5.65 2.14 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 179.937 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.714 ' O ' HG23 ' A' ' 42' ' ' VAL . 0.6 OUTLIER -159.9 71.41 0.47 Allowed 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 110.287 -0.264 . . . . 0.0 110.287 179.684 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.542 HG13 ' N ' ' A' ' 40' ' ' GLU . 11.9 p -38.69 -50.63 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.906 -179.564 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.542 ' N ' HG13 ' A' ' 39' ' ' VAL . 2.1 mm-40 -61.05 -43.28 99.12 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 109.954 -0.388 . . . . 0.0 109.954 179.321 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.43 ' O ' ' HG ' ' A' ' 45' ' ' LEU . . . -66.9 -45.69 81.07 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.474 -0.869 . . . . 0.0 111.902 178.846 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 1.057 HG21 HD23 ' A' ' 9' ' ' LEU . 15.5 t -45.94 -39.36 3.17 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.111 0 CA-C-O 121.208 0.528 . . . . 0.0 110.352 179.141 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 45.9 t-105 -78.3 -32.06 49.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.586 179.004 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.408 ' HA ' ' OD2' ' A' ' 47' ' ' ASP . 1.3 m -77.74 -50.99 11.26 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.982 179.89 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.77 ' O ' HG22 ' A' ' 49' ' ' ILE . 0.9 OUTLIER -56.9 -34.51 67.98 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.314 179.543 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.464 ' CD ' ' HB2' ' A' ' 16' ' ' ALA . 11.3 ttpp -67.52 -58.42 4.74 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.633 179.877 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.408 ' OD2' ' HA ' ' A' ' 44' ' ' THR . 4.7 p30 -62.64 -27.43 69.21 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.362 -179.928 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -79.98 -51.29 9.25 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.74 179.64 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.77 HG22 ' O ' ' A' ' 45' ' ' LEU . 3.8 tp -57.49 -24.24 21.5 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 C-N-CA 120.741 -0.383 . . . . 0.0 110.917 179.997 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.611 HD13 ' HB3' ' A' ' 19' ' ' GLU . 2.3 tp -82.05 -35.15 29.06 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 178.89 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 10.8 m -65.22 -14.52 60.86 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 115.602 -0.726 . . . . 0.0 111.677 179.49 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.564 ' CG ' ' O ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER . . . . . 0 N--CA 1.463 0.176 0 CA-C-O 121.288 0.566 . . . . 0.0 111.551 -179.498 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.713 HD21 ' CB ' ' A' ' 36' ' ' ALA . 6.8 tt . . . . . 0 N--CA 1.451 -0.395 0 CA-C-O 120.877 0.37 . . . . 0.0 111.12 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.494 ' HA ' ' HD3' ' A' ' 13' ' ' LYS . 3.7 tttt -52.56 -31.54 36.46 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.628 179.904 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 13.7 tt0 -87.61 -37.73 16.55 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.565 179.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -55.86 -38.18 69.77 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.519 179.473 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.652 ' HB3' HG11 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -85.05 -35.31 21.96 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.6 179.692 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.776 ' O ' HG22 ' A' ' 17' ' ' ILE . 2.3 mm-40 -58.09 -50.04 74.85 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 178.707 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -65.13 -31.05 72.05 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 177.84 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.696 ' HB1' ' CD1' ' A' ' 33' ' ' ILE . . . -68.22 -43.45 77.94 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 115.215 -0.902 . . . . 0.0 111.663 -179.838 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.776 HG22 ' O ' ' A' ' 14' ' ' GLU . 8.4 tp -60.31 -35.5 62.78 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.265 0 C-N-CA 120.645 -0.422 . . . . 0.0 109.875 179.933 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.84 -32.21 65.31 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 177.887 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.696 ' CG ' HD13 ' A' ' 50' ' ' LEU . 0.3 OUTLIER -62.2 -52.7 62.73 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.176 -0.92 . . . . 0.0 111.753 -179.797 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.803 HD22 HG13 ' A' ' 30' ' ' ILE . 0.2 OUTLIER -76.82 -34.45 57.9 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.878 -0.329 . . . . 0.0 110.99 -179.612 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.611 HG23 ' O ' ' A' ' 17' ' ' ILE . 24.1 t -61.55 -31.13 49.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 120.885 0.374 . . . . 0.0 110.199 179.386 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -90.3 -36.61 14.59 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.31 179.306 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -78.16 -14.95 59.26 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.19 179.603 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.423 ' N ' ' O ' ' A' ' 20' ' ' LEU . . . 50.47 105.3 0.01 OUTLIER Glycine 0 CA--C 1.522 0.504 0 C-N-CA 121.252 -0.499 . . . . 0.0 113.291 179.491 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.538 HG21 ' CE1' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -174.76 -171.94 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.377 0 CA-C-N 117.185 0.492 . . . . 0.0 111.678 179.397 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -40.85 95.94 0.01 OUTLIER 'General case' 0 C--O 1.232 0.14 0 CA-C-N 115.911 -0.586 . . . . 0.0 112.213 -179.186 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.428 ' O ' ' N ' ' A' ' 30' ' ' ILE . 21.3 mt-10 -53.0 -25.63 12.71 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.544 179.122 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.7 tptm -46.06 -45.54 16.19 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.388 179.152 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.783 ' CG ' HD13 ' A' ' 49' ' ' ILE . 2.8 m-85 -61.37 -30.52 70.59 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.041 179.585 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.803 HG13 HD22 ' A' ' 20' ' ' LEU . 40.9 mt -62.24 -26.67 40.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 177.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.407 ' O ' ' HB3' ' A' ' 35' ' ' ASN . 2.8 tttp -74.12 -37.13 64.19 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.629 179.386 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.587 ' HG ' ' O ' ' A' ' 29' ' ' TYR . 0.1 OUTLIER -62.38 -32.74 73.59 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 120.191 -0.604 . . . . 0.0 109.962 179.527 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.696 ' CD1' ' HB1' ' A' ' 16' ' ' ALA . 4.0 pt -91.85 -46.3 14.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.105 179.517 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.405 ' CB ' ' O ' ' A' ' 30' ' ' ILE . . . -60.64 -30.53 69.93 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.906 -179.576 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . 0.407 ' HB3' ' O ' ' A' ' 31' ' ' LYS . 34.1 t30 -83.48 -14.05 53.28 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.83 179.868 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.713 ' CB ' HD21 ' A' ' 9' ' ' LEU . . . 57.61 -138.74 0.88 Allowed 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.124 179.429 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.484 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 0.0 OUTLIER 89.07 -21.5 0.14 Allowed 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 122.582 0.353 . . . . 0.0 111.131 -179.54 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.727 ' O ' HG23 ' A' ' 42' ' ' VAL . 1.5 m -143.22 78.57 1.61 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.49 179.579 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.514 HG13 ' N ' ' A' ' 40' ' ' GLU . 7.8 p -40.51 -49.07 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.396 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.714 -179.642 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.514 ' N ' HG13 ' A' ' 39' ' ' VAL . 2.5 mt-10 -60.68 -43.22 97.97 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 179.421 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.421 ' O ' ' HG ' ' A' ' 45' ' ' LEU . . . -67.5 -47.88 60.21 Favored Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.55 -0.833 . . . . 0.0 111.935 179.073 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.727 HG23 ' O ' ' A' ' 38' ' ' THR . 8.8 t -43.58 -41.47 1.47 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.226 0 CA-C-O 121.188 0.518 . . . . 0.0 110.366 179.213 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 2.4 t-105 -78.38 -32.07 48.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.178 179.391 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.8 m -79.28 -48.85 13.41 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 120.782 0.325 . . . . 0.0 110.993 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.69 ' O ' HG22 ' A' ' 49' ' ' ILE . 1.8 mt -56.92 -36.87 70.71 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.056 179.569 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.572 ' HD3' ' HB2' ' A' ' 16' ' ' ALA . 7.4 ttpt -66.65 -60.2 2.92 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.486 179.309 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -57.71 -33.23 68.2 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.574 -179.916 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -76.35 -52.71 9.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.999 179.866 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.783 HD13 ' CG ' ' A' ' 29' ' ' TYR . 9.4 tp -59.43 -24.32 27.86 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.214 -179.83 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.696 HD13 ' CG ' ' A' ' 19' ' ' GLU . 3.2 tp -79.37 -34.34 42.09 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 178.741 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 23.0 m -59.04 -35.71 73.77 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.88 179.376 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.79 ' CG ' ' O ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.54 0.568 0 CA-C-O 121.447 0.642 . . . . 0.0 110.38 179.886 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 1.05 HD23 HG21 ' A' ' 42' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.98 0.419 . . . . 0.0 110.518 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.685 ' N ' HD13 ' A' ' 9' ' ' LEU . 35.7 mttt -59.38 -33.72 71.54 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.832 179.868 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.43 ' O ' ' HG2' ' A' ' 14' ' ' GLU . 2.3 mp0 -88.15 -36.55 16.78 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.056 -179.86 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.41 -37.23 72.42 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.84 0.352 . . . . 0.0 110.334 179.511 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.57 ' HB3' HG11 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -84.92 -37.38 20.61 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.773 179.678 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.477 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 4.1 pt-20 -56.56 -49.37 75.03 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 109.141 -0.688 . . . . 0.0 109.141 178.875 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.441 ' N ' ' CG ' ' A' ' 14' ' ' GLU . 0.8 OUTLIER -65.01 -31.54 72.83 Favored 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 108.774 -0.824 . . . . 0.0 108.774 177.738 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.703 ' HB1' ' CD1' ' A' ' 33' ' ' ILE . . . -65.09 -43.38 92.31 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.59 179.267 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.71 ' O ' HG23 ' A' ' 21' ' ' VAL . 37.1 mm -55.83 -48.26 78.5 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.207 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 178.771 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.6 pttt -60.98 -32.38 71.94 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.562 178.37 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.555 ' CG ' HD13 ' A' ' 50' ' ' LEU . 0.2 OUTLIER -65.76 -52.35 51.71 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.701 179.496 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.742 HD22 ' HB ' ' A' ' 30' ' ' ILE . 0.2 OUTLIER -73.55 -33.94 64.95 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.685 179.965 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.71 HG23 ' O ' ' A' ' 17' ' ' ILE . 54.4 t -64.64 -31.26 52.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 120.92 0.391 . . . . 0.0 110.169 179.219 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -88.77 -34.59 17.06 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.283 179.478 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.85 ' HB3' HD11 ' A' ' 25' ' ' ILE . . . -81.1 -15.22 56.55 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.313 179.505 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 41.73 82.67 0.02 OUTLIER Glycine 0 C--N 1.334 0.433 0 CA-C-N 116.216 -0.447 . . . . 0.0 113.846 179.362 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.85 HD11 ' HB3' ' A' ' 23' ' ' ALA . 0.1 OUTLIER -146.38 -163.3 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.219 0 CA-C-N 116.709 0.254 . . . . 0.0 110.909 179.397 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -43.89 95.3 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 120.782 0.325 . . . . 0.0 111.85 -179.447 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.626 ' O ' HG22 ' A' ' 30' ' ' ILE . 0.3 OUTLIER -52.18 -26.28 11.17 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.952 0.406 . . . . 0.0 110.561 179.415 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.5 tptm -46.69 -45.7 19.62 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-O 121.277 0.561 . . . . 0.0 110.319 179.135 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.788 ' CG ' HD13 ' A' ' 49' ' ' ILE . 3.6 m-85 -62.72 -31.01 71.85 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.878 179.558 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.742 ' HB ' HD22 ' A' ' 20' ' ' LEU . 1.6 tt -61.56 -26.51 39.8 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.627 178.322 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.03 -37.45 58.35 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.735 179.634 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.591 ' HG ' ' HA ' ' A' ' 29' ' ' TYR . 0.1 OUTLIER -60.52 -32.76 71.78 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 120.123 -0.631 . . . . 0.0 109.966 179.415 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.703 ' CD1' ' HB1' ' A' ' 16' ' ' ALA . 3.7 pt -91.76 -47.22 14.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.923 179.442 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.41 ' HB2' HD11 ' A' ' 17' ' ' ILE . . . -59.05 -29.23 67.15 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.999 -179.558 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 -85.72 -11.35 53.88 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.26 -179.763 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.632 ' CB ' HD21 ' A' ' 9' ' ' LEU . . . 56.88 -141.2 0.81 Allowed 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 116.774 -0.194 . . . . 0.0 111.065 179.615 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.484 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 0.0 OUTLIER 89.45 -21.33 0.14 Allowed 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 122.629 0.372 . . . . 0.0 111.34 179.978 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.892 ' O ' HG23 ' A' ' 42' ' ' VAL . 9.9 m -144.05 77.72 1.56 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.676 0.274 . . . . 0.0 110.55 179.791 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.529 HG13 ' N ' ' A' ' 40' ' ' GLU . 14.5 p -38.85 -48.44 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.405 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.703 -179.878 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.529 ' N ' HG13 ' A' ' 39' ' ' VAL . 1.8 tt0 -61.39 -52.86 62.84 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.153 179.569 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.753 ' H ' HG22 ' A' ' 38' ' ' THR . . . -61.79 -38.47 96.01 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.323 -0.942 . . . . 0.0 112.158 179.188 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 1.05 HG21 HD23 ' A' ' 9' ' ' LEU . 22.8 t -49.24 -45.32 17.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.938 0.399 . . . . 0.0 110.503 179.372 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.486 ' CZ2' ' HA ' ' A' ' 40' ' ' GLU . 1.1 p90 -79.04 -25.66 43.18 Favored 'General case' 0 N--CA 1.457 -0.121 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.028 179.308 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.422 ' N ' ' CD1' ' A' ' 43' ' ' TRP . 1.3 m -79.3 -47.53 15.7 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-O 120.885 0.374 . . . . 0.0 110.862 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.69 ' O ' HG22 ' A' ' 49' ' ' ILE . 4.4 mm? -61.19 -33.54 73.62 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.01 179.527 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.566 ' HD3' ' HB2' ' A' ' 16' ' ' ALA . 17.5 ttpt -67.85 -59.6 3.17 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.395 179.422 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.52 -32.56 70.41 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.291 179.888 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -76.35 -51.95 10.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.97 179.84 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.788 HD13 ' CG ' ' A' ' 29' ' ' TYR . 8.6 tp -59.85 -23.86 27.79 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.243 0 C-N-CA 120.691 -0.403 . . . . 0.0 111.353 -179.804 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.555 HD13 ' CG ' ' A' ' 19' ' ' GLU . 3.2 tp -79.77 -34.62 39.63 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 178.802 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 9.3 m -67.21 -17.08 64.67 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.569 -0.741 . . . . 0.0 111.826 179.514 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.65 ' CE1' HG21 ' A' ' 25' ' ' ILE . 0.0 OUTLIER . . . . . 0 N--CA 1.462 0.162 0 CA-C-O 121.502 0.667 . . . . 0.0 111.074 179.964 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.735 HD21 ' HB2' ' A' ' 36' ' ' ALA . 7.4 tt . . . . . 0 N--CA 1.455 -0.195 0 CA-C-O 120.867 0.365 . . . . 0.0 111.275 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.489 ' HA ' ' HD3' ' A' ' 13' ' ' LYS . 0.8 OUTLIER -51.82 -32.6 32.31 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.745 179.962 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 2.6 tm0? -89.89 -29.14 18.75 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.879 179.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.97 -37.44 87.41 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.106 179.347 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.645 ' HB3' HG11 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -85.27 -35.39 21.56 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.862 179.66 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.72 ' O ' HG22 ' A' ' 17' ' ' ILE . 0.1 OUTLIER -61.21 -47.34 86.54 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 179.218 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -65.76 -34.19 77.61 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 177.913 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.523 ' HB1' ' CD1' ' A' ' 33' ' ' ILE . . . -68.33 -36.83 79.85 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.5 179.39 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.72 HG22 ' O ' ' A' ' 14' ' ' GLU . 1.1 tp -58.19 -35.89 55.09 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.249 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 179.286 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 19.8 mttt -75.11 -33.07 61.56 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.654 178.347 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.618 ' HB3' HD13 ' A' ' 50' ' ' LEU . 0.4 OUTLIER -62.2 -52.32 64.26 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.659 179.407 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.79 HD22 ' HB ' ' A' ' 30' ' ' ILE . 0.3 OUTLIER -69.93 -34.79 73.93 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.685 179.946 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.712 HG23 ' O ' ' A' ' 17' ' ' ILE . 37.7 t -64.78 -31.29 53.18 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.229 0 CA-C-O 120.937 0.399 . . . . 0.0 109.933 179.091 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -84.21 -38.09 21.01 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.031 179.15 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.748 ' HB3' HD11 ' A' ' 25' ' ' ILE . . . -76.79 -15.3 59.78 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.141 179.333 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.401 ' C ' HG13 ' A' ' 25' ' ' ILE . . . 41.18 90.07 0.01 OUTLIER Glycine 0 C--N 1.335 0.495 0 CA-C-N 116.211 -0.449 . . . . 0.0 113.856 179.258 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.748 HD11 ' HB3' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -155.51 -164.71 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.271 0 CA-C-O 120.713 0.292 . . . . 0.0 110.922 179.179 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.559 ' HB3' ' CD2' ' A' ' 29' ' ' TYR . . . -44.75 95.76 0.01 OUTLIER 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.844 -179.586 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.651 ' O ' HG22 ' A' ' 30' ' ' ILE . 53.2 mt-10 -48.42 -26.96 2.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.674 179.432 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 12.2 tptm -44.96 -45.45 10.53 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.504 179.274 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.615 ' HA ' ' HG ' ' A' ' 32' ' ' LEU . 75.8 m-85 -61.05 -32.52 72.15 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.422 0.629 . . . . 0.0 110.128 179.614 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.79 ' HB ' HD22 ' A' ' 20' ' ' LEU . 2.2 tt -61.9 -26.38 39.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.705 178.484 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.9 tppp? -75.68 -35.6 60.31 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.576 179.472 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.893 ' HB2' HD23 ' A' ' 45' ' ' LEU . 0.2 OUTLIER -59.77 -35.18 74.1 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 120.361 -0.536 . . . . 0.0 109.749 179.316 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.523 ' CD1' ' HB1' ' A' ' 16' ' ' ALA . 2.9 pt -90.76 -46.33 14.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.945 179.402 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -60.51 -28.82 68.68 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.086 -179.704 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 -84.41 -12.93 53.52 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.406 -179.7 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.735 ' HB2' HD21 ' A' ' 9' ' ' LEU . . . 62.7 -136.17 0.44 Allowed 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 116.86 -0.155 . . . . 0.0 110.84 179.61 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.489 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 0.0 OUTLIER 87.64 -14.86 0.42 Allowed 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 179.808 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.654 ' O ' HG23 ' A' ' 42' ' ' VAL . 5.5 t -158.82 79.17 0.78 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.868 0.366 . . . . 0.0 110.635 179.388 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.697 ' CA ' HD12 ' A' ' 9' ' ' LEU . 10.2 p -38.65 -49.97 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.483 0 CA-C-N 115.894 -0.593 . . . . 0.0 111.753 -179.794 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.548 ' N ' HG13 ' A' ' 39' ' ' VAL . 2.8 mt-10 -60.19 -43.09 96.19 Favored 'General case' 0 CA--C 1.52 -0.194 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 179.365 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.407 ' N ' ' O ' ' A' ' 38' ' ' THR . . . -67.66 -46.7 66.54 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.448 -0.882 . . . . 0.0 111.921 178.752 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.654 HG23 ' O ' ' A' ' 38' ' ' THR . 12.2 t -43.97 -40.99 1.65 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.197 0 CA-C-O 121.062 0.458 . . . . 0.0 110.399 179.339 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 4.6 t-105 -78.64 -32.26 47.27 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.163 179.39 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.6 m -79.14 -45.12 20.63 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.887 0.375 . . . . 0.0 110.913 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.893 HD23 ' HB2' ' A' ' 32' ' ' LEU . 0.4 OUTLIER -60.06 -34.98 74.16 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.894 179.546 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.452 ' HA ' HG22 ' A' ' 49' ' ' ILE . 9.7 ttpt -68.05 -61.04 2.04 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.366 179.409 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -57.03 -32.71 66.45 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.365 179.801 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -76.46 -52.82 9.09 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.811 179.772 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.727 HG22 ' O ' ' A' ' 45' ' ' LEU . 6.2 tp -59.39 -23.86 26.45 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.32 0 C-N-CA 120.759 -0.376 . . . . 0.0 111.179 -179.895 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.618 HD13 ' HB3' ' A' ' 19' ' ' GLU . 5.4 tp -79.57 -32.54 42.04 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.19 0.519 . . . . 0.0 109.613 178.856 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 16.3 m -68.31 -20.69 64.76 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.602 -0.726 . . . . 0.0 112.049 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.614 ' CG ' ' O ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER . . . . . 0 N--CA 1.465 0.276 0 CA-C-O 121.635 0.731 . . . . 0.0 111.185 -179.74 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.951 ' CD1' HG21 ' A' ' 42' ' ' VAL . 1.3 tp . . . . . 0 N--CA 1.455 -0.185 0 CA-C-O 120.929 0.395 . . . . 0.0 110.815 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.441 ' HA ' ' HD3' ' A' ' 13' ' ' LYS . 0.7 OUTLIER -59.39 -34.61 72.65 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.864 -179.938 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -88.5 -30.91 19.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.782 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.05 -37.75 83.75 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.085 179.321 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.613 ' HB3' HG11 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -85.03 -37.03 20.85 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.752 179.626 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.47 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 0.3 OUTLIER -58.45 -47.28 84.53 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 179.229 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -66.39 -33.11 74.97 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 177.837 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.609 ' HB1' ' CD1' ' A' ' 33' ' ' ILE . . . -64.0 -36.93 85.59 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.394 179.268 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.768 ' O ' HG23 ' A' ' 21' ' ' VAL . 4.9 mm -60.94 -50.95 78.45 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.337 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 178.697 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.29 -32.2 66.39 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.355 -0.839 . . . . 0.0 109.851 178.498 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.602 ' CG ' HD13 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -61.88 -52.47 63.99 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.081 179.694 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.863 HD22 HG13 ' A' ' 30' ' ' ILE . 0.2 OUTLIER -79.39 -29.58 42.13 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.756 -179.984 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.768 HG23 ' O ' ' A' ' 17' ' ' ILE . 65.0 t -64.91 -32.43 58.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.274 179.571 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -90.0 -38.11 13.85 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.035 179.232 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -76.24 -14.72 60.12 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.023 179.283 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 48.25 97.67 0.01 OUTLIER Glycine 0 C--N 1.332 0.344 0 C-N-CA 121.143 -0.551 . . . . 0.0 113.002 179.58 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.658 HG21 ' CE1' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -160.11 -166.64 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.26 0 CA-C-N 116.899 0.35 . . . . 0.0 111.125 179.734 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -47.76 94.56 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.85 -179.549 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.414 ' O ' ' N ' ' A' ' 30' ' ' ILE . 4.2 mm-40 -51.24 -26.9 7.85 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.069 0.461 . . . . 0.0 110.48 179.267 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -46.8 -44.81 19.53 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.065 178.926 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.757 ' CG ' HD13 ' A' ' 49' ' ' ILE . 3.5 m-85 -60.76 -31.72 71.06 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.067 179.5 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.863 HG13 HD22 ' A' ' 20' ' ' LEU . 43.2 mt -61.57 -26.53 39.85 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 CA-C-N 115.967 -0.56 . . . . 0.0 109.507 178.02 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.3 tttp -74.45 -35.92 63.35 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.477 179.399 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.902 ' HB2' HD23 ' A' ' 45' ' ' LEU . 0.2 OUTLIER -61.36 -33.83 74.3 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 120.377 -0.529 . . . . 0.0 109.93 179.464 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.609 ' CD1' ' HB1' ' A' ' 16' ' ' ALA . 2.3 pt -91.83 -46.65 14.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.831 179.506 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.402 ' CB ' ' O ' ' A' ' 30' ' ' ILE . . . -58.85 -29.56 67.03 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.889 -179.659 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 24.0 t30 -85.13 -7.07 59.24 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.218 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.798 ' HB1' HD21 ' A' ' 9' ' ' LEU . . . 51.62 -138.74 1.04 Allowed 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 116.704 -0.225 . . . . 0.0 111.248 179.401 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.51 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 0.0 OUTLIER 93.1 -24.66 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 122.749 0.419 . . . . 0.0 111.072 -179.886 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.699 ' O ' HG23 ' A' ' 42' ' ' VAL . 1.9 p -145.88 81.14 1.6 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.576 179.794 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.518 HG13 ' N ' ' A' ' 40' ' ' GLU . 13.6 p -41.79 -47.59 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.36 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.691 -179.863 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.518 ' N ' HG13 ' A' ' 39' ' ' VAL . 1.8 mt-10 -60.56 -41.83 95.37 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 179.461 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -72.21 -42.22 51.09 Favored Glycine 0 C--O 1.223 -0.589 0 C-N-CA 120.332 -0.937 . . . . 0.0 112.229 178.968 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.951 HG21 ' CD1' ' A' ' 9' ' ' LEU . 25.3 t -45.78 -44.75 4.75 Favored 'Isoleucine or valine' 0 C--O 1.232 0.182 0 CA-C-N 116.978 0.389 . . . . 0.0 110.927 179.583 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.475 ' CD1' ' HA ' ' A' ' 40' ' ' GLU . 13.1 p-90 -79.23 -28.84 42.51 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.177 179.669 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.7 m -79.73 -36.73 36.93 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 120.487 -0.485 . . . . 0.0 110.948 179.856 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.902 HD23 ' HB2' ' A' ' 32' ' ' LEU . 1.0 OUTLIER -68.14 -32.52 72.85 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.147 -0.479 . . . . 0.0 109.79 179.375 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.512 ' HD3' ' HB2' ' A' ' 16' ' ' ALA . 8.2 ttpt -69.81 -61.53 1.74 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.273 179.263 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -57.3 -27.71 62.4 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.103 179.579 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -79.91 -53.58 6.63 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.733 179.715 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.757 HD13 ' CG ' ' A' ' 29' ' ' TYR . 6.3 tp -58.33 -24.45 24.72 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.129 0 C-N-CA 120.729 -0.388 . . . . 0.0 111.027 -179.954 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.602 HD13 ' CG ' ' A' ' 19' ' ' GLU . 1.0 OUTLIER -80.91 -34.66 33.28 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 178.812 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 8.5 m -65.75 -15.69 63.08 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.699 179.483 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.658 ' CE1' HG21 ' A' ' 25' ' ' ILE . 0.0 OUTLIER . . . . . 0 CA--C 1.534 0.346 0 CA-C-O 121.604 0.716 . . . . 0.0 111.241 -179.651 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.969 ' CD1' HG21 ' A' ' 42' ' ' VAL . 4.1 tp . . . . . 0 C--O 1.232 0.145 0 CA-C-O 120.923 0.392 . . . . 0.0 111.296 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.414 ' HA ' ' HD3' ' A' ' 13' ' ' LYS . 3.2 mtpt -57.46 -36.76 71.85 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.298 -179.636 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -85.12 -39.14 18.25 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.073 -179.798 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.74 -38.04 66.66 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.622 179.684 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.747 ' HB3' HG11 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -85.03 -35.66 21.76 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.756 179.608 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.459 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 3.1 mm-40 -60.05 -50.52 73.4 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 179.075 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 68.8 tt0 -64.83 -31.81 73.22 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 178.038 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.577 ' CB ' HD12 ' A' ' 33' ' ' ILE . . . -65.0 -37.78 88.78 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.175 179.194 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.802 ' O ' HG23 ' A' ' 21' ' ' VAL . 20.6 mm -58.03 -46.31 87.98 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.169 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 178.398 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.69 -32.22 73.26 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.272 -0.877 . . . . 0.0 109.47 178.237 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.519 ' CB ' HD13 ' A' ' 50' ' ' LEU . 0.4 OUTLIER -63.64 -52.42 60.87 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.565 179.268 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.803 HD22 ' HB ' ' A' ' 30' ' ' ILE . 0.3 OUTLIER -70.9 -33.98 71.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.66 179.88 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.802 HG23 ' O ' ' A' ' 17' ' ' ILE . 78.1 t -63.9 -31.17 52.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.908 0.385 . . . . 0.0 110.07 179.103 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -87.08 -37.89 17.0 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.244 179.371 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.515 ' HB3' HD11 ' A' ' 25' ' ' ILE . . . -77.57 -15.39 59.27 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.211 179.63 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 40.19 90.27 0.01 OUTLIER Glycine 0 C--N 1.335 0.482 0 CA-C-N 116.279 -0.419 . . . . 0.0 114.057 179.267 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.618 HD12 ' N ' ' A' ' 25' ' ' ILE . 0.2 OUTLIER -162.76 -167.71 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.227 0 CA-C-N 116.839 0.32 . . . . 0.0 111.138 179.06 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -33.66 95.89 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 112.398 0.518 . . . . 0.0 112.398 -179.169 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.457 ' O ' HG22 ' A' ' 30' ' ' ILE . 0.0 OUTLIER -56.21 -25.75 48.42 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.501 179.443 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.12 -46.1 11.65 Favored 'General case' 0 C--O 1.239 0.507 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.899 179.402 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.634 ' HA ' ' HG ' ' A' ' 32' ' ' LEU . 3.3 m-85 -64.37 -30.36 71.4 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.242 0.544 . . . . 0.0 110.242 179.848 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.803 ' HB ' HD22 ' A' ' 20' ' ' LEU . 0.9 OUTLIER -62.0 -26.39 39.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.415 178.175 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.7 ttmm -75.62 -37.83 59.43 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.55 179.484 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.634 ' HG ' ' HA ' ' A' ' 29' ' ' TYR . 0.1 OUTLIER -59.24 -33.74 71.38 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 120.102 -0.639 . . . . 0.0 109.783 179.43 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.63 HG22 ' HA ' ' A' ' 42' ' ' VAL . 4.9 pt -90.87 -48.33 14.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.807 179.272 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -56.2 -28.89 59.92 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.886 -179.864 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -88.62 -15.95 33.7 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.946 179.755 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.781 ' HB1' HD21 ' A' ' 9' ' ' LEU . . . 61.73 -137.7 0.51 Allowed 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.011 179.458 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.468 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 12.1 mttt 90.33 -22.86 0.1 Allowed 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 122.875 0.47 . . . . 0.0 111.23 -179.789 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.736 ' O ' HG23 ' A' ' 42' ' ' VAL . 0.7 OUTLIER -143.58 79.43 1.63 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.584 179.748 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.51 HG13 ' N ' ' A' ' 40' ' ' GLU . 13.5 p -40.15 -47.72 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.595 -179.93 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.51 ' N ' HG13 ' A' ' 39' ' ' VAL . 1.9 mt-10 -62.8 -43.95 97.45 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 179.427 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.471 ' O ' ' N ' ' A' ' 45' ' ' LEU . . . -66.49 -46.7 75.16 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.482 -0.866 . . . . 0.0 111.759 178.836 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.969 HG21 ' CD1' ' A' ' 9' ' ' LEU . 17.0 t -44.83 -41.48 2.23 Favored 'Isoleucine or valine' 0 C--O 1.234 0.248 0 CA-C-O 121.215 0.531 . . . . 0.0 110.27 179.109 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 31.7 t-105 -76.62 -31.51 57.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.957 179.098 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 m -80.53 -53.1 6.88 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.765 0.316 . . . . 0.0 110.986 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.708 ' O ' HG22 ' A' ' 49' ' ' ILE . 3.7 mm? -52.86 -35.73 57.95 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.035 0.445 . . . . 0.0 109.93 179.468 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.532 ' HG3' ' HA ' ' A' ' 16' ' ' ALA . 1.2 ttmt -68.05 -59.54 3.17 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.114 179.241 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -57.71 -31.47 66.43 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.234 179.768 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -77.16 -52.59 9.0 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.891 179.795 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.708 HG22 ' O ' ' A' ' 45' ' ' LEU . 7.1 tp -60.78 -23.88 30.57 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-O 120.792 0.329 . . . . 0.0 111.144 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.519 HD13 ' CB ' ' A' ' 19' ' ' GLU . 5.4 tp -79.33 -32.95 43.5 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 178.675 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 31.6 m -61.99 -36.63 82.06 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.2 179.519 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.782 ' CG ' ' O ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.539 0.524 0 CA-C-O 121.556 0.693 . . . . 0.0 110.635 -179.882 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 1.069 HD23 HG21 ' A' ' 42' ' ' VAL . 0.0 OUTLIER . . . . . 0 CA--C 1.53 0.183 0 CA-C-O 120.628 0.251 . . . . 0.0 111.143 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.896 ' N ' HD13 ' A' ' 9' ' ' LEU . 0.0 OUTLIER -51.96 -37.25 52.21 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.933 0.397 . . . . 0.0 111.234 -179.478 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.08 -30.31 19.99 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.142 -179.794 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.19 -37.1 85.9 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.261 179.579 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.494 ' HG2' ' N ' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -85.22 -37.69 19.81 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.948 179.701 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.494 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -56.46 -45.77 80.68 Favored 'General case' 0 C--O 1.233 0.234 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 179.068 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -68.27 -33.53 74.53 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.382 -0.826 . . . . 0.0 108.876 177.859 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.6 ' HB1' ' CD1' ' A' ' 33' ' ' ILE . . . -66.36 -37.41 85.24 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.317 179.54 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.773 ' O ' HG23 ' A' ' 21' ' ' VAL . 32.0 mm -58.81 -48.47 86.06 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.171 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 178.751 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.66 -32.86 73.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.691 178.5 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.602 ' CG ' HD13 ' A' ' 50' ' ' LEU . 0.3 OUTLIER -61.51 -52.41 64.61 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.549 -0.75 . . . . 0.0 111.06 179.861 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.575 HD22 ' HB ' ' A' ' 30' ' ' ILE . 0.2 OUTLIER -76.26 -34.91 59.15 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.951 -179.659 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.773 HG23 ' O ' ' A' ' 17' ' ' ILE . 71.3 t -63.42 -31.12 51.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 120.941 0.4 . . . . 0.0 110.374 179.528 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -91.49 -34.38 14.82 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.427 179.6 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -79.96 -15.17 57.82 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.323 179.791 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.791 ' O ' HG23 ' A' ' 25' ' ' ILE . . . 46.42 102.49 0.01 OUTLIER Glycine 0 CA--C 1.523 0.59 0 C-N-CA 121.315 -0.469 . . . . 0.0 113.334 179.476 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.802 HD12 ' CE1' ' A' ' 52' ' ' PHE . 1.1 pt -172.99 -173.4 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.21 0 CA-C-N 117.003 0.401 . . . . 0.0 111.326 179.501 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -36.84 95.14 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 -179.242 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.612 ' O ' HG22 ' A' ' 30' ' ' ILE . 1.6 pt-20 -54.14 -25.48 22.55 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.732 179.47 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -44.52 -47.49 10.14 Favored 'General case' 0 C--O 1.239 0.522 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.593 179.303 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.632 ' HA ' ' HG ' ' A' ' 32' ' ' LEU . 2.1 m-85 -63.81 -30.46 71.55 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.237 0.541 . . . . 0.0 110.06 179.655 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.612 HG22 ' O ' ' A' ' 27' ' ' GLU . 1.4 tt -60.81 -26.42 38.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.397 177.953 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.1 tptm -76.07 -37.55 58.11 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.593 179.515 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.725 ' HB2' HD13 ' A' ' 45' ' ' LEU . 0.1 OUTLIER -60.48 -32.42 71.41 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 119.885 -0.726 . . . . 0.0 109.856 179.349 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.6 ' CD1' ' HB1' ' A' ' 16' ' ' ALA . 4.6 pt -91.86 -48.34 13.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.851 179.456 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.652 ' HB2' HD11 ' A' ' 17' ' ' ILE . . . -58.54 -29.35 66.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.907 -179.687 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 7.8 t-20 -85.19 -17.96 35.55 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.936 179.768 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.533 ' CB ' HD21 ' A' ' 9' ' ' LEU . . . 61.28 -143.32 0.47 Allowed 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 116.626 -0.261 . . . . 0.0 110.923 179.612 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.497 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 0.0 OUTLIER 90.18 -21.79 0.12 Allowed 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 122.633 0.373 . . . . 0.0 111.406 -179.973 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.869 ' O ' HG23 ' A' ' 42' ' ' VAL . 0.6 OUTLIER -141.39 77.02 1.57 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.683 0.277 . . . . 0.0 110.639 179.878 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.507 HG13 ' N ' ' A' ' 40' ' ' GLU . 12.3 p -39.38 -47.04 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.63 -179.851 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.507 ' N ' HG13 ' A' ' 39' ' ' VAL . 0.4 OUTLIER -61.16 -52.69 63.76 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 179.563 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.454 ' O ' ' HG ' ' A' ' 45' ' ' LEU . . . -63.35 -37.55 95.02 Favored Glycine 0 C--O 1.226 -0.372 0 C-N-CA 120.246 -0.978 . . . . 0.0 112.186 179.234 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 1.069 HG21 HD23 ' A' ' 9' ' ' LEU . 29.1 t -49.9 -44.53 21.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 121.067 0.46 . . . . 0.0 110.387 179.416 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.499 ' CZ2' ' HA ' ' A' ' 40' ' ' GLU . 1.1 p90 -81.49 -24.54 36.66 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.283 179.234 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.8 m -79.98 -48.04 14.0 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-O 120.874 0.369 . . . . 0.0 110.616 179.885 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.725 HD13 ' HB2' ' A' ' 32' ' ' LEU . 2.1 mt -62.02 -32.36 72.84 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.863 179.26 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.439 ' HG3' ' HA ' ' A' ' 16' ' ' ALA . 4.0 tttm -67.67 -60.02 2.87 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.468 179.421 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -60.58 -30.23 69.68 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.301 179.748 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 -77.22 -52.29 9.48 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.974 179.802 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.694 HG22 ' O ' ' A' ' 45' ' ' LEU . 7.2 tp -60.25 -24.03 29.47 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.07 -179.943 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.602 HD13 ' CG ' ' A' ' 19' ' ' GLU . 3.3 tp -79.38 -32.84 43.16 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 178.469 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 50.9 m -59.66 -37.46 78.81 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.915 179.205 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.802 ' CE1' HD12 ' A' ' 25' ' ' ILE . 0.0 OUTLIER . . . . . 0 CA--C 1.539 0.549 0 CA-C-O 121.58 0.705 . . . . 0.0 110.536 179.813 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.727 HD21 ' HB2' ' A' ' 36' ' ' ALA . 9.2 tt . . . . . 0 N--CA 1.453 -0.29 0 CA-C-O 121.017 0.436 . . . . 0.0 110.721 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.465 ' HA ' ' HD3' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -52.21 -34.0 43.62 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.738 -0.664 . . . . 0.0 110.825 179.842 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.401 ' O ' ' HG3' ' A' ' 14' ' ' GLU . 0.8 OUTLIER -89.3 -29.67 19.0 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.775 179.802 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.4 -38.07 88.22 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.057 179.239 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.631 ' HB3' HG11 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -85.41 -35.45 21.3 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.037 179.704 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.544 ' O ' HG22 ' A' ' 17' ' ' ILE . 0.3 OUTLIER -59.9 -42.33 93.61 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 179.128 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -72.18 -30.93 65.45 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 177.833 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.649 ' CB ' HD12 ' A' ' 33' ' ' ILE . . . -68.67 -47.2 67.12 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.071 -0.968 . . . . 0.0 111.149 179.661 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.709 ' O ' HG23 ' A' ' 21' ' ' VAL . 0.5 OUTLIER -57.2 -39.24 65.95 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.235 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 179.145 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.09 -32.47 72.81 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 177.384 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.562 ' CG ' HD13 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -66.11 -49.59 66.99 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.478 179.152 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.796 HD22 ' HB ' ' A' ' 30' ' ' ILE . 0.2 OUTLIER -74.47 -35.75 63.28 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.948 -179.758 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.709 HG23 ' O ' ' A' ' 17' ' ' ILE . 44.0 t -63.4 -31.22 52.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 120.847 0.356 . . . . 0.0 110.21 179.461 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -89.51 -34.91 16.23 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.334 179.589 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.411 ' HB3' HD11 ' A' ' 25' ' ' ILE . . . -79.7 -14.97 58.37 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.355 179.779 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.654 ' O ' HG23 ' A' ' 25' ' ' ILE . . . 46.33 97.39 0.01 OUTLIER Glycine 0 CA--C 1.522 0.506 0 C-N-CA 121.051 -0.595 . . . . 0.0 113.287 179.603 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.721 ' N ' HD13 ' A' ' 25' ' ' ILE . 0.1 OUTLIER -162.09 -176.62 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.461 0.122 0 CA-C-N 116.884 0.342 . . . . 0.0 111.479 179.986 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -45.69 96.38 0.01 OUTLIER 'General case' 0 CA--C 1.518 -0.267 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.596 -179.452 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.539 ' O ' HG22 ' A' ' 30' ' ' ILE . 19.5 mm-40 -45.62 -25.11 0.42 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.194 178.681 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.402 ' CD ' HD21 ' A' ' 32' ' ' LEU . 0.1 OUTLIER -39.53 -50.59 2.19 Favored 'General case' 0 C--O 1.239 0.519 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.917 178.754 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.665 ' CG ' HD13 ' A' ' 49' ' ' ILE . 2.8 m-85 -65.47 -32.83 74.65 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.972 179.665 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.796 ' HB ' HD22 ' A' ' 20' ' ' LEU . 1.0 OUTLIER -59.76 -26.28 34.73 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.391 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.556 178.091 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.7 tttm -75.94 -37.81 58.28 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.455 179.494 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.636 ' HG ' ' HA ' ' A' ' 29' ' ' TYR . 0.1 OUTLIER -59.57 -33.03 70.92 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 120.18 -0.608 . . . . 0.0 109.766 179.308 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.744 HG22 ' HA ' ' A' ' 42' ' ' VAL . 3.8 pt -91.8 -45.9 14.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.967 179.573 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -58.48 -28.8 65.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.678 -179.866 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -88.62 -12.53 42.31 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.123 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.727 ' HB2' HD21 ' A' ' 9' ' ' LEU . . . 61.45 -140.02 0.5 Allowed 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 116.734 -0.212 . . . . 0.0 110.996 179.391 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.547 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 0.0 OUTLIER 96.33 -27.41 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 122.783 0.433 . . . . 0.0 110.758 -179.786 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.701 ' O ' HG23 ' A' ' 42' ' ' VAL . 0.6 OUTLIER -144.03 83.37 1.74 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.598 179.73 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.699 ' CA ' HD12 ' A' ' 9' ' ' LEU . 8.8 p -40.77 -48.18 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.464 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.475 -179.879 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.518 ' N ' HG13 ' A' ' 39' ' ' VAL . 0.0 OUTLIER -61.86 -43.0 99.73 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.846 -0.427 . . . . 0.0 109.846 179.304 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.475 ' O ' ' N ' ' A' ' 45' ' ' LEU . . . -66.58 -46.51 75.99 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.522 -0.847 . . . . 0.0 111.762 178.879 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.744 ' HA ' HG22 ' A' ' 33' ' ' ILE . 10.6 t -45.29 -41.97 2.93 Favored 'Isoleucine or valine' 0 C--O 1.233 0.201 0 CA-C-O 121.287 0.565 . . . . 0.0 110.196 179.168 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 14.3 t90 -76.76 -30.28 56.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.987 179.255 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.5 m -82.43 -54.62 5.06 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.831 0.348 . . . . 0.0 111.161 -179.782 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.688 ' O ' HG22 ' A' ' 49' ' ' ILE . 3.9 mm? -52.93 -32.49 45.94 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 179.306 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.5 ' HG3' ' HA ' ' A' ' 16' ' ' ALA . 0.3 OUTLIER -70.02 -60.77 2.09 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.271 -0.877 . . . . 0.0 110.245 179.296 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -58.25 -31.91 67.86 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.196 179.656 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -75.49 -54.98 6.14 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.836 179.763 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.688 HG22 ' O ' ' A' ' 45' ' ' LEU . 7.7 tp -56.84 -23.88 18.71 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.188 0 C-N-CA 120.705 -0.398 . . . . 0.0 111.236 -179.85 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.562 HD13 ' CG ' ' A' ' 19' ' ' GLU . 4.2 tp -79.04 -34.91 43.42 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 178.931 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 17.4 m -66.06 -18.05 65.09 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.755 179.719 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.551 ' CG ' ' O ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.532 0.257 0 CA-C-O 121.467 0.651 . . . . 0.0 111.215 -179.732 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 43.9 m . . . . . 0 N--CA 1.489 1.508 0 CA-C-O 120.675 0.274 . . . . 0.0 111.382 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER 59.33 161.23 0.04 OUTLIER 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.867 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 7.3 t80 -107.76 26.51 10.22 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.566 -179.838 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.6 ' O ' HD12 ' A' ' 5' ' ' LEU . 0.2 OUTLIER -145.01 66.08 1.25 Allowed 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.869 179.82 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.6 HD12 ' O ' ' A' ' 4' ' ' LYS . 5.1 mp -146.5 62.79 1.21 Allowed 'General case' 0 C--O 1.235 0.325 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.813 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 3.4 pt -101.25 80.4 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.159 179.631 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 48.2 mt -131.85 137.83 48.23 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.796 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 6.1 p-10 -156.22 42.04 0.38 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.669 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.647 HD13 ' HB1' ' A' ' 36' ' ' ALA . 2.4 pp -67.67 -32.61 73.39 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.056 -179.854 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 17.4 tttm -54.36 -38.32 65.95 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.146 0.498 . . . . 0.0 110.354 179.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.403 ' HA ' ' HB2' ' A' ' 14' ' ' GLU . 0.1 OUTLIER -90.43 -32.91 16.21 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.388 179.393 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.539 ' HB3' ' HA ' ' A' ' 9' ' ' LEU . . . -60.06 -38.27 82.32 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.504 179.377 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.594 ' HB3' HG11 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -85.41 -36.85 20.41 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.445 179.352 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.466 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 6.1 mm-40 -56.48 -50.45 71.73 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 178.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -64.17 -34.24 77.62 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 177.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.593 ' HB1' ' CD1' ' A' ' 33' ' ' ILE . . . -65.19 -38.87 91.83 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.4 179.391 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.722 ' O ' HG23 ' A' ' 21' ' ' VAL . 26.1 mm -55.62 -50.03 69.85 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.168 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 178.767 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -60.62 -33.18 72.4 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.736 -0.666 . . . . 0.0 109.964 178.642 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.647 ' HB3' HD13 ' A' ' 50' ' ' LEU . 0.1 OUTLIER -61.74 -52.47 64.12 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.661 179.496 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.744 HD22 ' HB ' ' A' ' 30' ' ' ILE . 0.2 OUTLIER -76.08 -34.28 59.54 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.673 179.886 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.722 HG23 ' O ' ' A' ' 17' ' ' ILE . 64.1 t -64.43 -31.2 52.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-O 120.866 0.365 . . . . 0.0 110.086 179.38 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -88.24 -35.95 17.02 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.203 179.313 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.986 ' HB1' HG21 ' A' ' 53' ' ' THR . . . -78.84 -15.37 58.46 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.245 179.536 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 41.87 79.69 0.05 OUTLIER Glycine 0 CA--C 1.522 0.508 0 CA-C-N 116.307 -0.406 . . . . 0.0 113.799 179.451 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.845 HD11 ' HB3' ' A' ' 23' ' ' ALA . 0.1 OUTLIER -144.2 -162.63 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.233 0 CA-C-N 116.812 0.306 . . . . 0.0 110.999 179.346 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -43.25 95.45 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.185 0 CA-C-O 120.863 0.364 . . . . 0.0 111.801 -179.497 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.635 ' O ' HG22 ' A' ' 30' ' ' ILE . 0.4 OUTLIER -52.87 -26.03 13.48 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.576 179.504 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.96 -45.92 15.95 Favored 'General case' 0 C--O 1.237 0.445 0 CA-C-O 121.344 0.592 . . . . 0.0 110.294 179.223 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.826 ' CD1' HD13 ' A' ' 49' ' ' ILE . 4.0 m-85 -62.69 -31.82 72.79 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.074 179.657 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.744 ' HB ' HD22 ' A' ' 20' ' ' LEU . 1.8 tt -60.9 -26.56 39.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.0 -0.545 . . . . 0.0 109.659 178.445 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -76.62 -37.64 56.04 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.879 179.738 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.588 ' HG ' ' O ' ' A' ' 29' ' ' TYR . 0.0 OUTLIER -60.99 -32.29 71.87 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 120.034 -0.666 . . . . 0.0 109.941 179.51 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.593 ' CD1' ' HB1' ' A' ' 16' ' ' ALA . 3.9 pt -91.86 -45.99 14.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.017 179.365 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.38 -29.68 67.88 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.879 -179.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -87.29 -14.55 40.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.006 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.647 ' HB1' HD13 ' A' ' 9' ' ' LEU . . . 57.75 -131.71 1.36 Allowed 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.115 179.822 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.459 ' HB2' ' O ' ' A' ' 36' ' ' ALA . 0.0 OUTLIER 85.1 -19.24 0.34 Allowed 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 122.611 0.364 . . . . 0.0 111.131 -179.737 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.654 ' O ' HG23 ' A' ' 42' ' ' VAL . 0.2 OUTLIER -147.17 77.78 1.46 Allowed 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 179.583 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.521 HG13 ' N ' ' A' ' 40' ' ' GLU . 14.9 p -40.64 -49.19 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.953 -179.378 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.521 ' N ' HG13 ' A' ' 39' ' ' VAL . 0.4 OUTLIER -59.17 -42.68 91.38 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.778 -0.452 . . . . 0.0 109.778 179.373 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -69.15 -47.1 55.32 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.432 -0.889 . . . . 0.0 111.983 178.791 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.654 HG23 ' O ' ' A' ' 38' ' ' THR . 21.3 t -43.5 -41.59 1.43 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.249 0 CA-C-O 121.135 0.493 . . . . 0.0 110.538 179.322 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 39.2 t-105 -78.18 -32.16 49.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.784 -0.643 . . . . 0.0 110.988 179.512 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.8 m -78.47 -47.37 17.58 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.962 0.41 . . . . 0.0 110.992 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.71 ' O ' HG22 ' A' ' 49' ' ' ILE . 3.8 mm? -58.5 -35.1 71.7 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.228 179.525 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.451 ' HD3' ' HB2' ' A' ' 16' ' ' ALA . 1.7 ttpm? -68.12 -59.99 2.82 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.403 179.493 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.11 -31.58 69.06 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.361 179.797 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -77.42 -53.5 7.58 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 115.916 -0.583 . . . . 0.0 111.054 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.826 HD13 ' CD1' ' A' ' 29' ' ' TYR . 7.5 tp -57.01 -24.14 19.78 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.194 0 C-N-CA 120.702 -0.399 . . . . 0.0 111.203 -179.756 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.647 HD13 ' HB3' ' A' ' 19' ' ' GLU . 2.2 tp -80.13 -36.46 35.21 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 178.697 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 23.7 m -57.29 -24.64 56.24 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.622 178.831 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.577 ' CE1' HG21 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -86.96 15.78 5.6 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-O 120.811 0.338 . . . . 0.0 111.042 179.647 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.986 HG21 ' HB1' ' A' ' 23' ' ' ALA . 2.5 t -152.86 55.63 0.78 Allowed 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 121.054 0.454 . . . . 0.0 110.956 179.786 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 22.8 t -127.75 106.84 15.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.408 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 66.2 p -115.26 38.46 3.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.808 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 . . . . . 0 C--O 1.248 0.975 0 CA-C-O 118.128 -0.939 . . . . 0.0 110.781 -179.89 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 3.9 p . . . . . 0 N--CA 1.492 1.647 0 CA-C-O 121.13 0.49 . . . . 0.0 110.925 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.432 ' O ' ' CG ' ' A' ' 3' ' ' TYR . 0.9 OUTLIER -153.99 -50.49 0.09 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.919 -179.999 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . 0.432 ' CG ' ' O ' ' A' ' 2' ' ' THR . 30.6 p90 43.81 29.7 0.32 Allowed 'General case' 0 C--N 1.331 -0.23 0 O-C-N 123.586 0.554 . . . . 0.0 111.437 -179.532 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -171.57 -53.38 0.02 OUTLIER 'General case' 0 C--O 1.234 0.249 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.958 -179.886 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.448 HD23 HD11 ' A' ' 7' ' ' LEU . 0.2 OUTLIER 62.85 123.68 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.645 -179.932 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 13.9 mt -112.54 95.2 3.64 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.126 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.211 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.448 HD11 HD23 ' A' ' 5' ' ' LEU . 0.2 OUTLIER -130.53 166.23 21.02 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.48 179.772 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . 0.683 ' OD1' HG21 ' A' ' 39' ' ' VAL . 10.2 p-10 -111.69 4.28 18.44 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.346 -179.825 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.653 HD13 ' HB1' ' A' ' 36' ' ' ALA . 2.6 pp -85.54 -35.16 21.29 Favored 'General case' 0 N--CA 1.455 -0.181 0 CA-C-O 120.887 0.375 . . . . 0.0 111.068 179.873 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.423 ' HA ' ' HD3' ' A' ' 13' ' ' LYS . 0.6 OUTLIER -52.22 -35.93 50.84 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.398 179.712 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 4.5 mt-30 -90.51 -32.52 16.3 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.467 179.442 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.429 ' HB3' ' HA ' ' A' ' 9' ' ' LEU . . . -60.81 -37.75 83.05 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.371 179.451 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.586 ' HB3' HG11 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -85.46 -37.47 19.71 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.419 179.466 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.476 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 5.8 mm-40 -57.77 -50.45 73.22 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 179.173 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -65.27 -32.46 74.13 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 177.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.547 ' HB1' ' CD1' ' A' ' 33' ' ' ILE . . . -66.97 -37.5 84.36 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.42 179.437 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.774 ' O ' HG23 ' A' ' 21' ' ' VAL . 21.0 mm -57.45 -48.21 83.3 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.14 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 178.713 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 18.4 mttt -63.59 -33.3 75.31 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.822 178.568 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.815 ' HB3' HD13 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -59.96 -52.24 66.24 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.692 179.53 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.575 HD22 ' HB ' ' A' ' 30' ' ' ILE . 0.3 OUTLIER -75.86 -32.41 59.73 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.747 -179.852 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.774 HG23 ' O ' ' A' ' 17' ' ' ILE . 53.9 t -64.3 -31.25 52.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.252 179.408 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -90.32 -38.3 13.46 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.436 179.591 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.454 ' O ' HG13 ' A' ' 25' ' ' ILE . . . -78.77 -15.55 58.28 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.438 179.797 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.721 ' O ' HG23 ' A' ' 25' ' ' ILE . . . 40.58 90.04 0.01 OUTLIER Glycine 0 C--N 1.335 0.515 0 CA-C-N 116.344 -0.389 . . . . 0.0 113.739 179.381 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.721 HG23 ' O ' ' A' ' 24' ' ' GLY . 0.4 OUTLIER -176.2 136.2 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.227 0 CA-C-O 121.072 0.463 . . . . 0.0 111.707 179.445 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . 38.11 89.97 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 115.616 -0.72 . . . . 0.0 112.558 179.696 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.634 ' O ' HG22 ' A' ' 30' ' ' ILE . 0.0 OUTLIER -62.82 -29.38 70.69 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.283 0.563 . . . . 0.0 109.637 178.557 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 2.6 tptt -46.08 -45.19 16.07 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.481 179.11 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.58 ' HA ' ' HG ' ' A' ' 32' ' ' LEU . 3.6 m-85 -64.0 -31.63 72.88 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.085 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.634 HG22 ' O ' ' A' ' 27' ' ' GLU . 1.6 tt -60.94 -26.19 38.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.732 178.322 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 12.7 tttt -77.89 -37.58 47.67 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.057 179.729 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.629 ' HB2' HD13 ' A' ' 45' ' ' LEU . 0.0 OUTLIER -60.69 -32.07 71.31 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 120.214 -0.594 . . . . 0.0 109.839 179.688 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.547 ' CD1' ' HB1' ' A' ' 16' ' ' ALA . 5.0 pt -91.7 -45.83 14.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.986 179.47 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.404 ' HB2' HD11 ' A' ' 17' ' ' ILE . . . -60.35 -29.09 68.67 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.003 -179.799 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 -86.47 -15.8 39.04 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.253 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.653 ' HB1' HD13 ' A' ' 9' ' ' LEU . . . 59.22 -139.4 0.72 Allowed 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 116.662 -0.245 . . . . 0.0 110.893 179.634 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.527 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 1.4 tptt 94.81 -26.71 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 122.688 0.395 . . . . 0.0 110.855 -179.691 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.667 ' O ' HG23 ' A' ' 42' ' ' VAL . 1.2 m -142.95 82.45 1.76 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.461 179.588 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.683 HG21 ' OD1' ' A' ' 8' ' ' ASN . 11.5 p -41.29 -47.66 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.568 -179.484 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.514 ' N ' HG13 ' A' ' 39' ' ' VAL . 1.8 mt-10 -60.39 -43.92 96.15 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.877 -0.416 . . . . 0.0 109.877 179.292 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.634 ' O ' ' HG ' ' A' ' 45' ' ' LEU . . . -67.91 -47.23 61.61 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 120.424 -0.893 . . . . 0.0 111.948 178.815 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.667 HG23 ' O ' ' A' ' 38' ' ' THR . 21.9 t -43.72 -41.52 1.56 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.259 0 CA-C-O 121.177 0.513 . . . . 0.0 110.584 179.195 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 37.0 t90 -78.59 -30.88 46.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.086 179.497 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.8 m -78.88 -44.93 21.74 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 120.722 0.296 . . . . 0.0 111.105 -179.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.703 ' O ' HG22 ' A' ' 49' ' ' ILE . 1.2 mt -61.86 -34.13 75.43 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.044 179.572 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.469 ' HG3' ' HA ' ' A' ' 16' ' ' ALA . 1.2 ttpt -68.38 -60.72 2.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.473 179.539 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -58.08 -30.51 66.28 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.247 179.713 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.61 -54.0 6.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.922 179.769 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.703 HG22 ' O ' ' A' ' 45' ' ' LEU . 5.3 tp -57.67 -24.06 21.68 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.141 0 C-N-CA 120.9 -0.32 . . . . 0.0 111.193 -179.892 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.815 HD13 ' HB3' ' A' ' 19' ' ' GLU . 4.3 tp -80.29 -35.86 35.21 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 178.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 17.3 m -66.26 -15.91 63.59 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.788 179.695 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.537 ' CG ' ' O ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -91.55 27.14 2.08 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-O 121.158 0.504 . . . . 0.0 111.509 -179.478 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.662 ' O ' HG22 ' A' ' 53' ' ' THR . 4.6 m -177.06 70.46 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.591 179.178 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 34.2 t -132.15 122.36 48.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.939 -179.492 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -127.43 106.39 9.16 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.821 179.786 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 . . . . . 0 C--O 1.246 0.882 0 CA-C-O 118.315 -0.85 . . . . 0.0 110.985 -179.984 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . 0.5 ' O ' HG23 ' A' ' 2' ' ' THR . 12.0 t . . . . . 0 N--CA 1.48 1.037 0 CA-C-O 120.902 0.382 . . . . 0.0 111.405 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.5 HG23 ' O ' ' A' ' 1' ' ' THR . 5.7 p -159.07 -53.03 0.06 Allowed 'General case' 0 N--CA 1.451 -0.405 0 CA-C-O 120.905 0.384 . . . . 0.0 110.979 -179.929 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 60.92 19.46 9.79 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.909 0.385 . . . . 0.0 110.834 179.475 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.535 ' O ' HD12 ' A' ' 5' ' ' LEU . 0.0 OUTLIER -154.1 77.65 1.09 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.646 -0.252 . . . . 0.0 111.11 179.959 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.535 HD12 ' O ' ' A' ' 4' ' ' LYS . 0.4 OUTLIER -168.05 93.68 0.38 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.881 179.949 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 4.6 pt -129.42 -47.84 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.258 179.835 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 2.2 pp 169.64 163.87 0.06 Allowed 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 120.968 0.413 . . . . 0.0 110.935 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -150.81 35.78 0.62 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.026 179.556 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.795 HD13 ' HB1' ' A' ' 36' ' ' ALA . 2.6 pp -85.38 -32.45 22.39 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.073 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.431 ' HA ' ' HD3' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -50.85 -37.91 46.01 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.092 0.473 . . . . 0.0 110.627 -179.958 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.0 -32.77 16.62 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.536 179.787 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.425 ' HB3' ' HA ' ' A' ' 9' ' ' LEU . . . -60.91 -37.52 82.56 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.498 179.46 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.531 ' HB3' HG11 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -85.35 -37.54 19.79 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.477 179.371 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.479 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 2.8 mm-40 -56.86 -50.56 72.1 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 178.947 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -64.33 -34.69 78.74 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 177.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.519 ' HB1' ' CD1' ' A' ' 33' ' ' ILE . . . -64.46 -37.98 89.41 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.225 179.286 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.817 ' O ' HG23 ' A' ' 21' ' ' VAL . 23.6 mm -56.3 -47.53 81.0 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.158 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 178.689 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 18.2 mttp -62.86 -33.27 74.92 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.912 178.684 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.584 ' CG ' HD13 ' A' ' 50' ' ' LEU . 0.6 OUTLIER -61.42 -52.31 65.12 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.636 179.549 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.746 HD22 ' HB ' ' A' ' 30' ' ' ILE . 0.2 OUTLIER -72.51 -35.03 68.02 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.772 -179.963 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.817 HG23 ' O ' ' A' ' 17' ' ' ILE . 70.2 t -63.27 -31.17 51.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 120.809 0.338 . . . . 0.0 110.244 179.36 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -88.86 -36.09 16.18 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.463 179.508 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 1.07 ' HB1' HG21 ' A' ' 53' ' ' THR . . . -78.32 -15.42 58.74 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.341 179.715 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.402 ' C ' HG13 ' A' ' 25' ' ' ILE . . . 41.34 90.43 0.01 OUTLIER Glycine 0 CA--C 1.524 0.612 0 C-N-CA 121.507 -0.378 . . . . 0.0 113.792 179.44 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.745 HD11 ' HB3' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -156.32 -163.54 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 CA-C-N 116.649 0.224 . . . . 0.0 110.915 179.387 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -45.17 95.07 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 120.823 0.344 . . . . 0.0 111.699 -179.613 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.565 ' O ' HG22 ' A' ' 30' ' ' ILE . 7.8 mt-10 -52.24 -25.64 9.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.778 179.455 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -45.38 -46.81 13.42 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.593 179.402 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.642 ' HA ' ' HG ' ' A' ' 32' ' ' LEU . 1.1 m-85 -62.46 -30.42 71.23 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.283 0.563 . . . . 0.0 109.919 179.706 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.746 ' HB ' HD22 ' A' ' 20' ' ' LEU . 1.3 tt -60.81 -26.25 37.91 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.361 0 CA-C-N 115.778 -0.646 . . . . 0.0 109.361 177.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.42 -37.2 57.41 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.64 179.607 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.642 ' HG ' ' HA ' ' A' ' 29' ' ' TYR . 0.1 OUTLIER -59.82 -33.89 72.35 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 120.068 -0.653 . . . . 0.0 109.813 179.359 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.519 ' CD1' ' HB1' ' A' ' 16' ' ' ALA . 4.2 pt -90.78 -46.71 14.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.966 179.541 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.408 ' HB2' HD11 ' A' ' 17' ' ' ILE . . . -57.6 -28.64 63.81 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.774 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 16.6 t-20 -89.43 -15.72 32.54 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.944 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.795 ' HB1' HD13 ' A' ' 9' ' ' LEU . . . 59.08 -134.95 0.89 Allowed 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 116.67 -0.241 . . . . 0.0 110.964 179.633 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.492 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 5.6 ttmm 89.98 -22.61 0.11 Allowed 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 122.699 0.4 . . . . 0.0 111.145 -179.894 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.657 ' O ' HG23 ' A' ' 42' ' ' VAL . 1.2 m -145.67 79.0 1.56 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.396 179.675 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.513 HG13 ' N ' ' A' ' 40' ' ' GLU . 10.0 p -39.54 -48.54 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.426 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.641 -179.63 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.513 ' N ' HG13 ' A' ' 39' ' ' VAL . 3.1 mt-10 -58.08 -45.72 86.66 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 179.369 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -69.13 -43.59 71.09 Favored Glycine 0 N--CA 1.447 -0.594 0 C-N-CA 120.408 -0.901 . . . . 0.0 112.182 178.844 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.657 HG23 ' O ' ' A' ' 38' ' ' THR . 23.7 t -43.27 -46.69 1.49 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.175 0 CA-C-O 120.879 0.371 . . . . 0.0 110.834 179.696 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.491 ' CZ2' ' HA ' ' A' ' 40' ' ' GLU . 1.1 p90 -78.47 -27.52 46.33 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 120.612 -0.435 . . . . 0.0 110.979 179.277 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.434 ' N ' ' CD1' ' A' ' 43' ' ' TRP . 3.2 m -76.62 -49.28 16.64 Favored 'General case' 0 N--CA 1.463 0.184 0 C-N-CA 120.75 -0.38 . . . . 0.0 110.839 179.825 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.699 ' O ' HG22 ' A' ' 49' ' ' ILE . 3.6 mt -59.79 -33.07 71.23 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.224 179.585 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.415 ' HD2' ' HA ' ' A' ' 16' ' ' ALA . 6.7 ttpt -67.97 -59.0 3.6 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.359 179.562 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -60.66 -31.71 70.92 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.241 179.689 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -76.23 -52.64 9.61 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.931 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.699 HG22 ' O ' ' A' ' 45' ' ' LEU . 7.4 tp -58.43 -23.97 23.83 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.257 0 C-N-CA 120.784 -0.367 . . . . 0.0 111.16 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.584 HD13 ' CG ' ' A' ' 19' ' ' GLU . 1.5 tp -79.24 -34.94 42.3 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 178.549 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 34.3 m -61.26 -24.32 66.3 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.313 179.238 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.58 ' CE1' HG21 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -88.38 22.31 2.56 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 120.914 0.388 . . . . 0.0 111.179 -179.88 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 1.07 HG21 ' HB1' ' A' ' 23' ' ' ALA . 4.5 t -149.22 54.58 0.97 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.117 0.484 . . . . 0.0 111.246 179.662 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 41.9 t -147.85 -78.87 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.26 179.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -159.63 -166.79 1.84 Allowed 'General case' 0 N--CA 1.454 -0.265 0 CA-C-O 120.97 0.414 . . . . 0.0 110.942 179.63 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 12.9 tt0 . . . . . 0 C--O 1.248 0.984 0 CA-C-O 118.401 -0.809 . . . . 0.0 110.99 179.846 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 28.5 p . . . . . 0 N--CA 1.487 1.393 0 CA-C-O 120.924 0.392 . . . . 0.0 111.018 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 3.6 p -141.08 145.59 36.03 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.041 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . 0.699 ' HB2' HD13 ' A' ' 5' ' ' LEU . 13.0 p90 -112.87 -39.03 4.36 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.29 179.823 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 58.38 68.34 0.84 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.318 179.772 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.699 HD13 ' HB2' ' A' ' 3' ' ' TYR . 5.2 mp -135.14 178.0 7.37 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.182 0.515 . . . . 0.0 110.89 -179.873 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 5.2 mt -106.63 71.23 0.3 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.234 0 CA-C-O 121.101 0.477 . . . . 0.0 111.084 -179.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -109.23 147.27 32.84 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.623 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . 0.401 ' H ' HG21 ' A' ' 39' ' ' VAL . 27.5 t-20 -162.35 51.12 0.2 Allowed 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.167 -179.851 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.524 ' HB3' HG23 ' A' ' 39' ' ' VAL . 3.0 pp -77.11 -34.28 56.81 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.909 0.385 . . . . 0.0 110.627 179.683 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.435 ' HA ' ' HD3' ' A' ' 13' ' ' LYS . 0.7 OUTLIER -53.61 -37.8 63.38 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.247 179.55 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.408 ' HA ' ' HB2' ' A' ' 14' ' ' GLU . 1.7 tt0 -89.88 -32.64 16.78 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.347 179.441 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.482 ' HB3' ' HA ' ' A' ' 9' ' ' LEU . . . -59.88 -38.28 81.76 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.321 179.371 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.579 ' HB3' HG11 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -85.46 -35.16 21.4 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.636 179.394 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.848 ' O ' HG22 ' A' ' 17' ' ' ILE . 2.1 mm-40 -60.43 -50.44 73.57 Favored 'General case' 0 C--O 1.234 0.263 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 179.049 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -64.41 -34.49 78.3 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 178.026 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.505 ' HB1' ' CD1' ' A' ' 33' ' ' ILE . . . -67.26 -36.34 81.4 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 115.177 -0.919 . . . . 0.0 110.436 179.587 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.848 HG22 ' O ' ' A' ' 14' ' ' GLU . 1.8 tp -59.9 -33.55 53.06 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.209 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 179.18 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 4.5 mttp -76.7 -33.21 58.23 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.583 178.348 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.582 ' CG ' HD13 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -59.05 -52.44 65.72 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.677 179.419 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.734 HD22 ' HB ' ' A' ' 30' ' ' ILE . 0.3 OUTLIER -71.41 -35.86 71.13 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.895 -179.842 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.744 HG23 ' O ' ' A' ' 17' ' ' ILE . 41.1 t -62.33 -31.28 51.18 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-O 120.982 0.42 . . . . 0.0 110.119 179.28 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -88.58 -35.27 16.99 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.96 179.14 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 1.03 ' HB1' HG21 ' A' ' 53' ' ' THR . . . -77.12 -15.19 59.64 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.17 179.45 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 39.66 85.93 0.01 OUTLIER Glycine 0 CA--C 1.521 0.449 0 CA-C-N 116.235 -0.439 . . . . 0.0 113.905 179.358 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.649 HD12 ' HG ' ' A' ' 20' ' ' LEU . 0.8 OUTLIER -163.41 -171.18 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 CA-C-N 116.716 0.258 . . . . 0.0 111.118 179.15 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.409 ' O ' HD21 ' A' ' 20' ' ' LEU . . . -28.78 95.73 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -179.096 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.616 ' O ' HG22 ' A' ' 30' ' ' ILE . 0.3 OUTLIER -58.96 -25.54 63.65 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.464 179.46 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -44.15 -46.6 8.84 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.681 179.473 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.934 ' CG ' HD13 ' A' ' 49' ' ' ILE . 3.5 m-85 -62.39 -31.24 71.88 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.291 0.567 . . . . 0.0 110.169 179.743 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.734 ' HB ' HD22 ' A' ' 20' ' ' LEU . 1.9 tt -60.79 -26.28 37.94 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.485 178.149 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 13.9 tttt -76.54 -37.13 57.14 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.704 179.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.618 ' HG ' ' HA ' ' A' ' 29' ' ' TYR . 0.1 OUTLIER -60.73 -32.67 71.93 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 120.095 -0.642 . . . . 0.0 109.834 179.494 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.505 ' CD1' ' HB1' ' A' ' 16' ' ' ALA . 5.1 pt -91.5 -45.62 14.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.966 179.444 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.56 -28.94 67.56 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.868 -179.823 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 20.6 t30 -87.97 -14.37 39.34 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.174 -179.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.533 ' O ' ' CB ' ' A' ' 37' ' ' LYS . . . 57.28 -139.42 0.88 Allowed 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 116.738 -0.21 . . . . 0.0 111.085 179.553 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.533 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 0.9 OUTLIER 95.44 -27.38 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 122.843 0.457 . . . . 0.0 110.734 -179.752 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.652 ' O ' HG23 ' A' ' 42' ' ' VAL . 1.0 OUTLIER -142.25 82.89 1.81 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.3 179.564 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.524 HG23 ' HB3' ' A' ' 9' ' ' LEU . 14.8 p -41.83 -47.21 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.307 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.658 -179.64 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.511 ' N ' HG13 ' A' ' 39' ' ' VAL . 0.0 OUTLIER -60.2 -43.29 96.04 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 179.254 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -68.87 -46.96 58.04 Favored Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.481 -0.866 . . . . 0.0 112.008 178.791 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.652 HG23 ' O ' ' A' ' 38' ' ' THR . 21.7 t -43.88 -41.88 1.7 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-O 121.135 0.493 . . . . 0.0 110.518 179.18 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 64.1 t-105 -77.71 -31.69 52.45 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.094 179.438 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.8 m -78.61 -44.6 23.56 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 120.748 0.309 . . . . 0.0 111.085 -179.831 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.689 ' O ' HG22 ' A' ' 49' ' ' ILE . 3.8 mm? -60.58 -35.07 75.19 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.083 179.479 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.447 ' CD ' ' HB2' ' A' ' 16' ' ' ALA . 0.8 OUTLIER -68.24 -60.38 2.51 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.459 179.554 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -59.47 -29.73 68.03 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.322 179.739 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -78.14 -54.24 6.47 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.974 179.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.934 HD13 ' CG ' ' A' ' 29' ' ' TYR . 8.6 tp -56.1 -24.32 17.48 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 C-N-CA 120.828 -0.349 . . . . 0.0 111.061 -179.735 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.854 ' O ' HG13 ' A' ' 54' ' ' VAL . 1.2 tp -81.07 -35.7 31.4 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 178.526 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.513 ' O ' HG22 ' A' ' 54' ' ' VAL . 7.5 m -55.58 -27.37 48.87 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.244 178.724 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.603 ' HD2' ' O ' ' A' ' 49' ' ' ILE . 0.0 OUTLIER -78.33 1.75 20.8 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-O 120.874 0.369 . . . . 0.0 110.27 178.836 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 1.03 HG21 ' HB1' ' A' ' 23' ' ' ALA . 2.1 t -145.39 50.7 1.21 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.253 179.243 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.854 HG13 ' O ' ' A' ' 50' ' ' LEU . 34.0 m -134.11 -174.26 1.15 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.274 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.016 -179.436 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.9 m 64.4 115.83 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.118 0 CA-C-O 121.134 0.492 . . . . 0.0 110.697 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.247 0.961 0 CA-C-O 118.158 -0.925 . . . . 0.0 110.994 179.763 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . 0.409 ' O ' ' N ' ' A' ' 3' ' ' TYR . 24.9 p . . . . . 0 N--CA 1.493 1.677 0 CA-C-O 120.602 0.239 . . . . 0.0 110.827 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.8 p 51.7 -87.35 0.01 OUTLIER 'General case' 0 C--O 1.236 0.372 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.385 179.813 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . 0.409 ' N ' ' O ' ' A' ' 1' ' ' THR . 19.5 t80 56.45 34.29 24.01 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.723 0.297 . . . . 0.0 110.82 179.803 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.66 86.15 1.52 Allowed 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.086 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -136.91 124.8 22.65 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.915 179.879 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 2.6 pt -102.08 33.69 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.336 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -155.89 121.21 4.84 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.83 -179.86 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 -162.42 50.11 0.18 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.869 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.765 HD13 ' HB1' ' A' ' 36' ' ' ALA . 3.1 pp -83.89 -32.53 25.13 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.912 -179.923 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 7.7 tttm -52.03 -38.84 58.33 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.032 0.444 . . . . 0.0 110.514 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.28 -33.2 18.13 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.445 179.553 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.452 ' HB3' ' HA ' ' A' ' 9' ' ' LEU . . . -59.64 -37.54 78.94 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.584 179.465 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.578 ' HB3' HG11 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -85.42 -35.97 20.96 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.526 179.425 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.46 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 23.9 mt-10 -57.04 -50.41 72.84 Favored 'General case' 0 C--O 1.237 0.403 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 178.915 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -63.96 -33.89 76.75 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 177.666 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.581 ' HB1' ' CD1' ' A' ' 33' ' ' ILE . . . -64.55 -38.49 91.18 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.205 179.246 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.875 ' O ' HG23 ' A' ' 21' ' ' VAL . 26.7 mm -56.12 -52.49 50.01 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.13 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 178.823 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.38 -33.06 70.73 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.845 178.58 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.556 ' CG ' HD13 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -59.95 -52.24 66.23 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.382 179.324 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.776 HD22 ' HB ' ' A' ' 30' ' ' ILE . 0.3 OUTLIER -72.74 -32.31 65.58 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.418 179.748 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.875 HG23 ' O ' ' A' ' 17' ' ' ILE . 87.9 t -62.6 -32.11 54.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 120.904 0.383 . . . . 0.0 110.276 179.328 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.407 ' OD2' ' HA ' ' A' ' 19' ' ' GLU . 1.5 p30 -88.19 -40.12 13.95 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.28 179.412 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.32 -15.28 60.96 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.178 179.424 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.421 ' C ' HG13 ' A' ' 25' ' ' ILE . . . 37.57 89.55 0.01 OUTLIER Glycine 0 CA--C 1.522 0.525 0 CA-C-N 116.121 -0.491 . . . . 0.0 114.036 179.296 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.703 HD12 ' HG ' ' A' ' 20' ' ' LEU . 0.5 OUTLIER -159.08 -168.83 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.214 0 CA-C-N 116.653 0.227 . . . . 0.0 111.058 179.285 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -33.47 95.73 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -179.269 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.655 ' O ' HG22 ' A' ' 30' ' ' ILE . 1.3 mp0 -54.41 -25.68 26.16 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.562 179.562 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.4 tptt -44.57 -46.37 9.94 Favored 'General case' 0 C--O 1.238 0.489 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.608 179.519 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.579 ' HA ' ' HG ' ' A' ' 32' ' ' LEU . 3.3 m-85 -62.97 -31.66 72.82 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.189 0.518 . . . . 0.0 110.209 179.819 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.776 ' HB ' HD22 ' A' ' 20' ' ' LEU . 2.0 tt -60.61 -26.17 37.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.683 178.347 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 7.1 tptt -77.44 -37.67 51.13 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.884 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.579 ' HG ' ' HA ' ' A' ' 29' ' ' TYR . 0.0 OUTLIER -60.96 -31.88 71.43 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 120.044 -0.662 . . . . 0.0 110.027 179.583 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.581 ' CD1' ' HB1' ' A' ' 16' ' ' ALA . 3.2 pt -91.72 -46.05 14.4 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.938 179.371 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -58.75 -28.87 66.31 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.953 -179.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 16.6 t-20 -89.12 -13.54 38.27 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.058 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.765 ' HB1' HD13 ' A' ' 9' ' ' LEU . . . 58.14 -136.32 0.95 Allowed 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 116.69 -0.232 . . . . 0.0 111.054 179.643 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.529 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 24.2 tttt 94.8 -26.86 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 122.767 0.427 . . . . 0.0 110.718 -179.701 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.649 ' O ' HG23 ' A' ' 42' ' ' VAL . 0.2 OUTLIER -144.4 83.17 1.71 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.31 179.673 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.505 HG13 ' N ' ' A' ' 40' ' ' GLU . 12.9 p -41.34 -47.52 0.79 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.651 -179.598 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.505 ' N ' HG13 ' A' ' 39' ' ' VAL . 0.4 OUTLIER -60.6 -43.27 97.61 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 179.194 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.581 ' O ' ' HG ' ' A' ' 45' ' ' LEU . . . -67.75 -46.52 67.27 Favored Glycine 0 N--CA 1.448 -0.567 0 C-N-CA 120.526 -0.845 . . . . 0.0 111.884 178.774 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.649 HG23 ' O ' ' A' ' 38' ' ' THR . 20.7 t -45.19 -39.63 2.25 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 CA-C-O 121.171 0.51 . . . . 0.0 110.494 179.281 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 1.9 t90 -79.56 -30.41 41.67 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.87 179.336 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.7 m -78.93 -48.25 14.92 Favored 'General case' 0 C--N 1.334 -0.084 0 CA-C-O 120.892 0.377 . . . . 0.0 110.836 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.746 ' O ' HG22 ' A' ' 49' ' ' ILE . 1.5 mt -59.3 -34.7 72.62 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.145 179.564 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.484 ' HD3' ' HB2' ' A' ' 16' ' ' ALA . 3.5 ttpp -68.51 -59.02 3.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.416 179.495 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.02 -30.1 67.76 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.223 179.676 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -78.04 -54.32 6.41 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.847 179.713 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.746 HG22 ' O ' ' A' ' 45' ' ' LEU . 4.1 tp -56.6 -23.93 18.15 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.208 0 C-N-CA 120.858 -0.337 . . . . 0.0 110.923 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.556 HD13 ' CG ' ' A' ' 19' ' ' GLU . 3.4 tp -80.74 -33.52 35.06 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 178.525 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 38.1 m -60.13 -26.34 66.19 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.617 -0.72 . . . . 0.0 111.199 179.462 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.759 ' CG ' ' O ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -86.06 44.17 1.11 Allowed 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 121.466 0.651 . . . . 0.0 111.01 -179.803 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.745 ' O ' HG12 ' A' ' 54' ' ' VAL . 1.2 m 169.22 -64.5 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 115.914 -0.585 . . . . 0.0 109.693 179.614 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.745 HG12 ' O ' ' A' ' 53' ' ' THR . 9.9 p 53.24 160.79 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.455 -0.183 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.933 179.707 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.449 ' N ' HG22 ' A' ' 54' ' ' VAL . 35.3 p 51.57 -81.5 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.424 -179.912 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.51 ' N ' ' O ' ' A' ' 54' ' ' VAL . 6.2 mm-40 . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.252 -0.88 . . . . 0.0 110.82 -179.781 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 10.3 t . . . . . 0 N--CA 1.488 1.45 0 CA-C-O 120.844 0.354 . . . . 0.0 111.195 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -152.59 139.58 19.15 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.236 0.541 . . . . 0.0 110.775 -179.736 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . 0.421 ' HB3' HD12 ' A' ' 5' ' ' LEU . 12.1 t80 -80.28 -19.22 47.24 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.415 179.614 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 5.6 ttpt 68.68 60.93 0.36 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.057 0.456 . . . . 0.0 110.629 179.698 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.421 HD12 ' HB3' ' A' ' 3' ' ' TYR . 1.5 mt -102.88 78.44 1.67 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.67 -179.938 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 4.2 mt 66.11 119.37 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.756 179.556 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 2.4 mm? 63.45 116.92 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.942 179.673 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . 0.461 ' H ' HG21 ' A' ' 39' ' ' VAL . 3.3 t30 -169.09 57.94 0.05 OUTLIER 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.592 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.757 HD13 ' HB1' ' A' ' 36' ' ' ALA . 3.1 pp -77.13 -32.51 56.49 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.977 -179.847 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.43 ' HA ' ' HD3' ' A' ' 13' ' ' LYS . 12.4 tttp -50.66 -37.38 40.54 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.571 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -89.97 -29.26 18.58 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.703 179.705 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.99 -38.25 90.41 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.172 179.298 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.562 ' HB3' HG11 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -85.6 -35.26 21.13 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.06 179.725 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.74 ' O ' HG22 ' A' ' 17' ' ' ILE . 0.4 OUTLIER -59.15 -43.96 92.07 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.58 0.705 . . . . 0.0 109.238 179.035 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -70.75 -31.08 67.76 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.442 -0.799 . . . . 0.0 108.973 177.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.595 ' HB1' ' CD1' ' A' ' 33' ' ' ILE . . . -70.42 -41.82 72.42 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 115.217 -0.901 . . . . 0.0 111.307 -179.743 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.74 HG22 ' O ' ' A' ' 14' ' ' GLU . 0.8 OUTLIER -60.09 -35.51 61.91 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.285 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 179.305 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -70.48 -32.5 70.04 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 108.979 -0.749 . . . . 0.0 108.979 177.54 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.612 ' HG3' HD13 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -63.44 -52.53 61.08 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.16 -0.927 . . . . 0.0 111.266 179.801 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.454 ' HG ' HG13 ' A' ' 25' ' ' ILE . 0.2 OUTLIER -77.45 -35.18 54.16 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.192 -179.461 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.566 HG23 ' O ' ' A' ' 17' ' ' ILE . 37.1 t -65.22 -31.01 52.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 120.883 0.373 . . . . 0.0 110.298 179.57 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 23.2 m-20 -91.12 -33.18 15.56 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.7 179.747 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -83.8 -14.96 50.13 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.526 179.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.425 ' C ' ' CG1' ' A' ' 25' ' ' ILE . . . 55.18 112.46 0.01 OUTLIER Glycine 0 CA--C 1.523 0.586 0 C-N-CA 121.071 -0.585 . . . . 0.0 112.951 179.481 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.562 HG21 ' CE1' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -178.82 -173.69 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.357 0 CA-C-N 117.165 0.482 . . . . 0.0 111.407 179.478 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -43.77 94.56 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.133 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.832 -179.421 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.585 ' O ' HG22 ' A' ' 30' ' ' ILE . 3.0 mt-10 -50.86 -26.74 6.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.528 179.347 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -46.67 -46.33 19.9 Favored 'General case' 0 C--O 1.238 0.483 0 CA-C-O 121.325 0.584 . . . . 0.0 110.211 179.055 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.701 ' CG ' HD13 ' A' ' 49' ' ' ILE . 3.0 m-85 -62.08 -32.13 72.64 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 121.41 0.624 . . . . 0.0 109.767 179.413 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.585 HG22 ' O ' ' A' ' 27' ' ' GLU . 1.2 tt -60.59 -26.25 37.2 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.659 178.31 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.4 ttpt -76.2 -36.56 58.56 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.606 179.471 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.89 ' HB2' HD23 ' A' ' 45' ' ' LEU . 0.2 OUTLIER -59.73 -34.03 72.4 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 120.394 -0.523 . . . . 0.0 109.76 179.188 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.601 HG22 ' HA ' ' A' ' 42' ' ' VAL . 2.9 pt -91.82 -45.56 14.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.959 179.6 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.67 -29.41 68.04 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.771 -179.836 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 30.7 t30 -87.39 -12.68 45.55 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.031 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.757 ' HB1' HD13 ' A' ' 9' ' ' LEU . . . 59.28 -134.31 0.9 Allowed 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.062 179.675 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.52 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 1.0 OUTLIER 92.9 -40.59 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 122.79 0.436 . . . . 0.0 110.537 -179.686 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.612 ' O ' HG23 ' A' ' 42' ' ' VAL . 13.8 p -129.97 82.47 2.07 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.25 179.476 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.536 HG13 ' N ' ' A' ' 40' ' ' GLU . 12.6 p -41.69 -49.14 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.358 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.772 -179.63 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.536 ' N ' HG13 ' A' ' 39' ' ' VAL . 0.1 OUTLIER -58.34 -41.83 85.52 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 179.168 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -68.96 -47.67 53.03 Favored Glycine 0 N--CA 1.448 -0.554 0 C-N-CA 120.609 -0.805 . . . . 0.0 111.982 178.811 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.612 HG23 ' O ' ' A' ' 38' ' ' THR . 17.4 t -42.84 -40.78 1.04 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.192 0 CA-C-O 121.191 0.52 . . . . 0.0 110.493 179.23 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 68.0 t-105 -79.21 -32.89 44.12 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.199 179.342 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.6 m -79.79 -49.62 11.75 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-O 120.997 0.427 . . . . 0.0 111.021 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.89 HD23 ' HB2' ' A' ' 32' ' ' LEU . 0.4 OUTLIER -56.81 -34.97 68.21 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.033 179.428 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.447 ' HG3' ' HA ' ' A' ' 16' ' ' ALA . 3.5 tttm -68.54 -60.21 2.59 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.4 179.341 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -57.98 -32.27 67.73 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.415 179.714 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -76.18 -53.49 8.2 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.08 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.71 HG22 ' O ' ' A' ' 45' ' ' LEU . 7.3 tp -57.38 -24.28 21.24 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.171 0 C-N-CA 120.649 -0.42 . . . . 0.0 111.265 -179.777 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.612 HD13 ' HG3' ' A' ' 19' ' ' GLU . 2.2 tp -79.24 -35.84 40.91 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 178.794 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 44.1 m -59.31 -25.44 64.16 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.011 178.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.562 ' CE1' HG21 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -89.05 17.86 5.45 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-O 120.924 0.392 . . . . 0.0 111.042 -179.992 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.598 ' O ' HG23 ' A' ' 53' ' ' THR . 10.6 t -148.31 58.4 1.08 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.136 0.493 . . . . 0.0 111.357 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.537 HG13 ' OXT' ' A' ' 56' ' ' GLU . 9.9 p -151.81 142.73 15.86 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.314 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.315 179.504 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.36 -69.33 0.24 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.983 -179.765 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.537 ' OXT' HG13 ' A' ' 54' ' ' VAL . 8.4 mt-10 . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.453 -0.784 . . . . 0.0 111.445 179.594 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . 0.467 HG22 ' H ' ' A' ' 2' ' ' THR . 1.3 m . . . . . 0 N--CA 1.489 1.51 0 CA-C-O 120.69 0.281 . . . . 0.0 111.274 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.597 HG21 HD21 ' A' ' 5' ' ' LEU . 1.6 p -122.86 -44.93 2.18 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.043 179.734 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 61.79 17.09 8.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.141 -179.923 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -171.25 93.83 0.17 Allowed 'General case' 0 CA--C 1.522 -0.101 0 CA-C-O 121.114 0.483 . . . . 0.0 110.76 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.597 HD21 HG21 ' A' ' 2' ' ' THR . 5.0 mt -130.91 -66.23 0.76 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.082 179.919 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 18.9 tt -178.18 158.57 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.208 179.735 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.716 HD12 HG11 ' A' ' 39' ' ' VAL . 6.0 mt -97.39 -82.91 0.4 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.75 -179.532 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 19.2 t30 -179.45 51.03 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.961 0.41 . . . . 0.0 111.041 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.77 HD13 ' HB1' ' A' ' 36' ' ' ALA . 3.4 pp -74.18 -32.48 63.1 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.027 179.912 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.47 -38.3 53.14 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.734 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.44 -29.12 20.43 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.783 179.691 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.67 -37.05 85.87 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.198 179.466 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.586 ' HB3' HG11 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -85.27 -37.81 19.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.75 179.54 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.48 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -56.97 -46.73 81.98 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 179.101 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.404 ' N ' ' HG3' ' A' ' 14' ' ' GLU . 6.8 tp10 -66.42 -36.06 81.86 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 177.952 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.532 ' HA ' ' HG3' ' A' ' 46' ' ' LYS . . . -64.22 -39.76 94.64 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 115.147 -0.933 . . . . 0.0 110.193 179.368 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.727 HD13 HG12 ' A' ' 30' ' ' ILE . 25.7 mm -54.39 -46.91 70.29 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.167 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 178.57 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 24.3 mmtm -62.01 -33.23 73.95 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.717 178.366 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.547 ' HG3' HD13 ' A' ' 50' ' ' LEU . 0.5 OUTLIER -62.04 -52.53 63.59 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.613 179.55 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.704 HD22 ' HB ' ' A' ' 30' ' ' ILE . 0.2 OUTLIER -76.86 -34.4 57.82 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.942 -179.818 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.708 HG23 ' O ' ' A' ' 17' ' ' ILE . 52.8 t -63.08 -31.24 51.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 120.866 0.365 . . . . 0.0 110.188 179.535 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -90.26 -35.37 15.34 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.6 179.513 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.415 ' O ' ' O ' ' A' ' 24' ' ' GLY . . . -79.02 -15.26 58.48 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.4 179.732 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.872 ' O ' HG23 ' A' ' 25' ' ' ILE . . . 44.37 105.9 0.01 OUTLIER Glycine 0 CA--C 1.526 0.758 0 N-CA-C 114.243 0.457 . . . . 0.0 114.243 179.009 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.872 HG23 ' O ' ' A' ' 24' ' ' GLY . 1.7 pp -176.41 -170.86 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 CA-C-N 116.823 0.312 . . . . 0.0 110.556 178.646 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -35.91 94.97 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.325 0 N-CA-C 112.225 0.454 . . . . 0.0 112.225 -179.387 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.618 ' O ' HG22 ' A' ' 30' ' ' ILE . 4.7 pt-20 -54.55 -25.38 25.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.67 179.572 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -43.08 -47.68 6.06 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.928 179.457 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.669 ' HA ' ' HG ' ' A' ' 32' ' ' LEU . 3.4 m-85 -63.12 -32.75 74.21 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.292 0.568 . . . . 0.0 110.092 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.727 HG12 HD13 ' A' ' 17' ' ' ILE . 1.4 tt -59.71 -26.27 34.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.67 178.295 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.5 tppp? -76.83 -37.06 56.36 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.637 179.583 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.896 ' HB2' HD23 ' A' ' 45' ' ' LEU . 0.2 OUTLIER -58.95 -34.06 71.32 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 120.299 -0.56 . . . . 0.0 109.802 179.379 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.607 HG22 ' HA ' ' A' ' 42' ' ' VAL . 3.0 pt -91.68 -45.88 14.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.882 179.378 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.513 ' HB2' HD11 ' A' ' 17' ' ' ILE . . . -57.99 -28.89 64.8 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.747 179.961 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 11.0 t-20 -88.05 -15.99 34.83 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.079 179.894 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.77 ' HB1' HD13 ' A' ' 9' ' ' LEU . . . 60.31 -137.84 0.65 Allowed 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.985 179.596 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.516 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 2.9 tppt? 93.69 -26.0 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 122.753 0.421 . . . . 0.0 110.87 -179.523 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.676 ' O ' HG23 ' A' ' 42' ' ' VAL . 10.2 m -142.55 81.61 1.74 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.401 179.566 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.716 HG11 HD12 ' A' ' 7' ' ' LEU . 12.3 p -41.95 -47.32 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.349 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.588 -179.693 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.506 ' N ' HG13 ' A' ' 39' ' ' VAL . 0.1 OUTLIER -60.27 -42.43 95.4 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 179.3 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.6 ' H ' HG22 ' A' ' 38' ' ' THR . . . -69.85 -47.59 46.59 Favored Glycine 0 N--CA 1.448 -0.546 0 C-N-CA 120.506 -0.854 . . . . 0.0 111.949 178.86 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.676 HG23 ' O ' ' A' ' 38' ' ' THR . 17.0 t -43.14 -41.97 1.24 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.163 0 CA-C-O 121.134 0.492 . . . . 0.0 110.548 179.239 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 2.6 t-105 -77.17 -32.65 56.34 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.762 -0.653 . . . . 0.0 111.02 179.325 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.7 m -80.52 -52.14 7.96 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 120.815 0.341 . . . . 0.0 111.072 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.896 HD23 ' HB2' ' A' ' 32' ' ' LEU . 0.4 OUTLIER -53.64 -34.2 57.76 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.922 179.445 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.532 ' HG3' ' HA ' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -69.17 -60.64 2.21 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.02 179.233 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -57.76 -30.82 65.93 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.169 179.659 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -77.01 -52.74 8.82 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.103 179.701 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.73 HG22 ' O ' ' A' ' 45' ' ' LEU . 4.9 tp -57.12 -24.09 20.0 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.22 0 C-N-CA 120.589 -0.444 . . . . 0.0 111.054 -179.846 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.547 HD13 ' HG3' ' A' ' 19' ' ' GLU . 1.5 tp -80.09 -35.14 37.32 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 178.735 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 50.2 m -57.68 -27.85 63.26 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.74 178.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.555 ' C ' ' CD1' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -87.89 13.41 10.9 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-O 120.782 0.325 . . . . 0.0 110.918 179.636 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.538 ' O ' HG23 ' A' ' 53' ' ' THR . 13.7 t -149.97 55.34 0.94 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.119 0.485 . . . . 0.0 111.344 -179.611 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.539 HG23 ' O ' ' A' ' 50' ' ' LEU . 40.1 t -127.75 -79.77 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.147 179.855 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 39.6 m -75.87 114.16 14.17 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.699 0.285 . . . . 0.0 110.588 -179.703 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.148 -0.93 . . . . 0.0 110.729 179.757 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . 0.7 ' O ' HG23 ' A' ' 2' ' ' THR . 22.5 p . . . . . 0 N--CA 1.494 1.742 0 CA-C-O 121.36 0.6 . . . . 0.0 111.073 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.7 HG23 ' O ' ' A' ' 1' ' ' THR . 0.8 OUTLIER -168.22 -53.51 0.02 OUTLIER 'General case' 0 CA--C 1.521 -0.161 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.584 -179.92 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . 0.433 ' CG ' ' O ' ' A' ' 2' ' ' THR . 54.6 p90 44.23 29.96 0.41 Allowed 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.536 -179.357 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.62 78.79 0.71 Allowed 'General case' 0 N--CA 1.454 -0.23 0 CA-C-O 121.191 0.519 . . . . 0.0 110.697 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 18.3 mt -145.54 -177.54 5.62 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.923 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 1.9 pt -113.91 146.74 18.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.137 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -91.71 -58.95 2.25 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.928 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -177.86 48.1 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.675 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.788 ' HG ' HG21 ' A' ' 42' ' ' VAL . 4.6 tt -79.1 -43.12 24.75 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.18 -179.647 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -54.5 -36.67 64.45 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.51 179.769 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -87.04 -32.33 20.05 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.381 179.511 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.64 -37.24 78.14 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.481 179.408 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.624 ' HB3' HG11 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -85.1 -36.65 21.0 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.478 179.593 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.478 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 1.9 mm-40 -58.39 -50.39 73.86 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 178.949 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 56.5 tt0 -63.36 -34.55 77.97 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 177.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.564 ' CB ' HD12 ' A' ' 33' ' ' ILE . . . -63.57 -36.39 83.64 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 115.153 -0.93 . . . . 0.0 110.173 179.239 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.787 ' O ' HG23 ' A' ' 21' ' ' VAL . 20.4 mm -57.75 -49.17 81.73 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.139 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 178.762 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 20.4 mmtt -61.3 -33.14 73.08 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.97 178.651 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.594 ' HG3' HD13 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -59.01 -52.45 65.72 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.622 179.56 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.66 HD21 ' O ' ' A' ' 25' ' ' ILE . 0.2 OUTLIER -76.16 -29.81 57.87 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.537 179.772 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.787 HG23 ' O ' ' A' ' 17' ' ' ILE . 66.5 t -67.54 -31.2 51.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.959 0.409 . . . . 0.0 110.095 179.355 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -90.22 -33.84 16.03 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.191 179.423 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -84.66 -15.01 46.87 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.2 179.466 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.732 ' O ' HG23 ' A' ' 25' ' ' ILE . . . 40.4 86.19 0.01 OUTLIER Glycine 0 C--N 1.334 0.444 0 CA-C-N 116.299 -0.409 . . . . 0.0 113.645 179.576 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.732 HG23 ' O ' ' A' ' 24' ' ' GLY . 1.2 pp -172.66 138.54 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 CA-C-O 121.058 0.456 . . . . 0.0 112.033 179.53 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . 35.82 86.83 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 115.575 -0.739 . . . . 0.0 112.75 179.769 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.677 ' O ' HG22 ' A' ' 30' ' ' ILE . 1.3 mt-10 -61.66 -28.58 69.49 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.164 0.507 . . . . 0.0 109.669 178.606 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -45.92 -45.8 15.66 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.639 179.06 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.624 ' HA ' ' HG ' ' A' ' 32' ' ' LEU . 3.4 m-85 -65.58 -30.07 70.75 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.156 0.503 . . . . 0.0 110.284 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.677 HG22 ' O ' ' A' ' 27' ' ' GLU . 1.9 tt -61.8 -26.21 39.19 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 178.079 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.2 tppp? -76.33 -38.06 56.48 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.676 179.588 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.624 ' HG ' ' HA ' ' A' ' 29' ' ' TYR . 0.1 OUTLIER -59.72 -33.57 71.8 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 120.117 -0.633 . . . . 0.0 109.92 179.445 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.564 HD12 ' CB ' ' A' ' 16' ' ' ALA . 4.7 pt -90.18 -48.41 14.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.795 179.397 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -56.28 -28.07 57.48 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.95 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 20.9 t30 -91.54 -15.57 28.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.159 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.725 ' CB ' HD21 ' A' ' 9' ' ' LEU . . . 60.58 -162.81 0.26 Allowed 'General case' 0 C--N 1.333 -0.11 0 CA-C-O 120.499 0.19 . . . . 0.0 111.005 179.673 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.564 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 6.3 tttt 138.14 -52.97 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 123.786 0.834 . . . . 0.0 109.081 -179.478 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.66 ' O ' HG23 ' A' ' 42' ' ' VAL . 1.0 OUTLIER -129.24 101.74 6.14 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.333 -0.849 . . . . 0.0 109.847 178.946 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.542 ' N ' HD12 ' A' ' 9' ' ' LEU . 10.4 p -42.39 -38.09 0.77 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.326 0 CA-C-O 121.301 0.572 . . . . 0.0 110.81 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -69.84 -44.99 68.77 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.469 -0.787 . . . . 0.0 109.701 179.239 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -63.75 -45.16 95.08 Favored Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 120.349 -0.929 . . . . 0.0 111.335 178.745 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.788 HG21 ' HG ' ' A' ' 9' ' ' LEU . 11.7 t -48.18 -41.84 10.57 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-O 121.194 0.521 . . . . 0.0 110.008 178.919 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 48.2 t90 -77.34 -27.81 52.85 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.529 -0.76 . . . . 0.0 111.097 179.379 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.8 m -80.8 -48.84 11.9 Favored 'General case' 0 C--N 1.334 -0.107 0 CA-C-O 120.814 0.34 . . . . 0.0 111.035 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.731 ' O ' HG22 ' A' ' 49' ' ' ILE . 4.0 mm? -58.61 -34.75 71.49 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.103 179.56 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.456 ' HD2' ' HB2' ' A' ' 16' ' ' ALA . 12.2 tttm -68.46 -59.89 2.83 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.63 -0.713 . . . . 0.0 110.305 179.379 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -58.47 -31.03 67.44 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.361 179.681 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -77.1 -53.12 8.18 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.835 -0.621 . . . . 0.0 111.081 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.731 HG22 ' O ' ' A' ' 45' ' ' LEU . 4.6 tp -57.49 -23.91 20.77 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.143 0 C-N-CA 120.824 -0.35 . . . . 0.0 111.179 -179.872 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.594 HD13 ' HG3' ' A' ' 19' ' ' GLU . 2.0 tp -81.69 -32.34 31.75 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.692 -0.484 . . . . 0.0 109.692 178.782 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.449 ' HA ' ' CG2' ' A' ' 54' ' ' VAL . 17.0 m -64.79 -23.74 67.34 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.706 179.767 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.602 ' CD1' HD12 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -83.45 16.7 2.45 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 121.245 0.545 . . . . 0.0 111.351 179.871 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.65 ' O ' HG22 ' A' ' 53' ' ' THR . 3.1 m -175.7 69.36 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 108.469 -0.937 . . . . 0.0 108.469 178.955 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.511 HG13 ' O ' ' A' ' 50' ' ' LEU . 0.0 OUTLIER -128.36 -81.25 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.381 -0.827 . . . . 0.0 111.42 -178.362 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.6 m 68.78 151.88 0.09 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.966 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 59.1 mt-10 . . . . . 0 C--O 1.246 0.888 0 CA-C-O 118.4 -0.809 . . . . 0.0 110.825 179.984 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 62.1 m . . . . . 0 N--CA 1.491 1.62 0 CA-C-O 120.701 0.286 . . . . 0.0 111.143 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 14.9 p -132.62 143.2 49.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.209 179.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . 0.717 ' HB2' HD13 ' A' ' 5' ' ' LEU . 9.2 p90 -116.24 -38.95 3.47 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.563 179.857 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.453 ' C ' HD12 ' A' ' 5' ' ' LEU . 0.0 OUTLIER 62.79 66.58 0.75 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.843 179.782 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.717 HD13 ' HB2' ' A' ' 3' ' ' TYR . 5.5 mp -139.71 -55.89 0.56 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.951 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.772 HG22 ' HG ' ' A' ' 7' ' ' LEU . 20.7 mt -117.18 140.44 39.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.936 -179.566 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.772 ' HG ' HG22 ' A' ' 6' ' ' ILE . 20.6 mt 66.99 -171.22 0.19 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.399 179.762 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 12.4 t30 178.82 49.77 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.96 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.726 HD21 ' CB ' ' A' ' 36' ' ' ALA . 6.5 tt -76.28 -46.37 28.19 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.43 -179.095 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 4.9 mtpt -52.92 -37.79 61.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.8 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -87.52 -29.13 21.56 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.861 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.58 -36.62 84.39 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.196 179.497 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.699 ' O ' HD13 ' A' ' 17' ' ' ILE . 0.0 OUTLIER -85.27 -36.38 20.92 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.903 179.549 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.462 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 5.4 pt-20 -59.87 -50.11 75.08 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 179.159 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.443 ' N ' ' CG ' ' A' ' 14' ' ' GLU . 1.1 tp10 -65.0 -36.32 84.04 Favored 'General case' 0 CA--C 1.516 -0.345 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 178.183 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.458 ' HB1' HD13 ' A' ' 33' ' ' ILE . . . -64.45 -34.29 77.86 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 115.234 -0.893 . . . . 0.0 110.308 179.461 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.751 ' O ' HG23 ' A' ' 21' ' ' VAL . 1.3 mp -59.81 -45.83 94.37 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.277 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 178.808 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 11.3 mttt -65.46 -33.07 75.09 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.56 -0.746 . . . . 0.0 109.966 178.629 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.597 ' HG3' HD13 ' A' ' 50' ' ' LEU . 0.5 OUTLIER -56.88 -52.58 64.57 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.315 179.996 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.883 HD22 HG13 ' A' ' 30' ' ' ILE . 0.2 OUTLIER -77.63 -32.76 53.63 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.768 0.318 . . . . 0.0 110.711 -179.859 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.751 HG23 ' O ' ' A' ' 17' ' ' ILE . 55.6 t -62.82 -31.39 52.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-O 120.87 0.367 . . . . 0.0 110.203 179.464 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -90.82 -36.98 13.91 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.2 179.368 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -77.07 -14.92 59.75 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.072 179.367 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.408 ' N ' ' O ' ' A' ' 20' ' ' LEU . . . 49.71 100.99 0.01 OUTLIER Glycine 0 CA--C 1.523 0.533 0 C-N-CA 121.185 -0.531 . . . . 0.0 113.274 179.447 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.564 HG21 ' CE1' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -168.84 -169.55 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.253 0 CA-C-N 117.029 0.415 . . . . 0.0 111.403 179.345 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -43.24 95.33 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.006 -0.543 . . . . 0.0 112.143 -179.401 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.415 ' O ' ' N ' ' A' ' 30' ' ' ILE . 0.6 OUTLIER -52.61 -25.9 11.97 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.292 0.568 . . . . 0.0 110.513 179.107 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.4 ' O ' ' HB3' ' A' ' 31' ' ' LYS . 1.9 tptm -46.3 -44.91 17.01 Favored 'General case' 0 C--O 1.238 0.493 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.168 179.067 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.79 ' CG ' HD13 ' A' ' 49' ' ' ILE . 2.7 m-85 -61.46 -31.8 71.78 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.003 179.72 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.883 HG13 HD22 ' A' ' 20' ' ' LEU . 43.6 mt -60.65 -26.47 38.06 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.331 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 177.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.4 ' HB3' ' O ' ' A' ' 28' ' ' LYS . 0.1 OUTLIER -74.98 -37.32 61.94 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.694 179.429 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.607 ' HG ' ' HA ' ' A' ' 29' ' ' TYR . 0.1 OUTLIER -60.52 -33.37 72.55 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 120.03 -0.668 . . . . 0.0 109.841 179.55 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.636 HG22 ' HA ' ' A' ' 42' ' ' VAL . 3.7 pt -91.72 -46.69 14.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.987 179.619 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.447 ' HB2' HD11 ' A' ' 17' ' ' ILE . . . -58.71 -29.51 66.73 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.741 -179.949 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 -85.06 -12.91 51.96 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.921 179.841 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.726 ' CB ' HD21 ' A' ' 9' ' ' LEU . . . 58.59 -139.9 0.76 Allowed 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 116.656 -0.247 . . . . 0.0 110.97 179.445 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.545 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 0.4 OUTLIER 95.68 -27.12 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 122.797 0.439 . . . . 0.0 110.796 -179.855 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.707 ' O ' HG23 ' A' ' 42' ' ' VAL . 55.5 p -143.65 83.14 1.75 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.624 179.671 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.644 ' CA ' HD12 ' A' ' 9' ' ' LEU . 8.1 p -40.63 -48.85 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.494 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.531 ' N ' HG13 ' A' ' 39' ' ' VAL . 30.0 mm-40 -61.58 -41.45 97.43 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.283 -0.417 . . . . 0.0 109.957 179.61 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -68.03 -47.12 61.56 Favored Glycine 0 N--CA 1.448 -0.555 0 C-N-CA 120.519 -0.848 . . . . 0.0 111.788 178.733 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.707 HG23 ' O ' ' A' ' 38' ' ' THR . 11.9 t -43.8 -41.9 1.65 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.164 0 CA-C-O 121.276 0.56 . . . . 0.0 110.254 179.026 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 73.7 t-105 -78.3 -31.26 48.76 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.549 -0.751 . . . . 0.0 111.304 179.333 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.9 m -79.12 -49.2 12.98 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.84 0.352 . . . . 0.0 110.959 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.687 ' O ' HG22 ' A' ' 49' ' ' ILE . 1.8 mt -56.88 -34.9 68.32 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.064 -0.516 . . . . 0.0 109.928 179.459 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.447 ' HB2' ' CB ' ' A' ' 16' ' ' ALA . 12.8 tttm -67.87 -59.82 2.99 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.479 179.486 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.74 -32.64 69.41 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.497 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -76.19 -53.65 7.96 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.918 179.885 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.79 HD13 ' CG ' ' A' ' 29' ' ' TYR . 9.1 tp -58.41 -24.4 24.85 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.152 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.162 -179.73 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.597 HD13 ' HG3' ' A' ' 19' ' ' GLU . 4.1 tp -78.87 -34.54 44.86 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 178.753 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 35.6 m -58.35 -34.82 71.07 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.913 179.354 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.794 ' CG ' ' O ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -75.12 57.96 0.87 Allowed 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 121.577 0.703 . . . . 0.0 110.76 179.979 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.412 HG22 ' N ' ' A' ' 54' ' ' VAL . 1.1 m 170.44 -64.34 0.01 OUTLIER 'General case' 0 C--O 1.231 0.117 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 179.839 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.624 ' O ' HG23 ' A' ' 55' ' ' THR . 2.7 t -77.6 75.15 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.661 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.277 179.707 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.624 HG23 ' O ' ' A' ' 54' ' ' VAL . 0.1 OUTLIER 170.03 -65.22 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.623 -179.864 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 . . . . . 0 C--O 1.25 1.107 0 CA-C-O 118.205 -0.902 . . . . 0.0 110.817 179.943 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 3.1 p . . . . . 0 N--CA 1.487 1.394 0 CA-C-O 120.987 0.422 . . . . 0.0 111.109 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.475 ' HB ' HD11 ' A' ' 5' ' ' LEU . 0.1 OUTLIER -146.1 144.08 29.77 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.001 0.429 . . . . 0.0 110.973 179.671 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -98.15 34.95 1.83 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.05 179.694 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.445 ' C ' HD12 ' A' ' 5' ' ' LEU . 1.1 tmtt? -149.72 84.2 1.41 Allowed 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.84 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.475 HD11 ' HB ' ' A' ' 2' ' ' THR . 5.0 mp -150.38 167.88 25.77 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.717 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.51 HD11 ' CB ' ' A' ' 9' ' ' LEU . 0.5 OUTLIER -145.51 -44.68 0.12 Allowed 'Isoleucine or valine' 0 C--O 1.223 -0.301 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.45 179.738 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 39.8 tp -167.01 -77.94 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.816 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 21.7 p30 -162.14 40.38 0.13 Allowed 'General case' 0 N--CA 1.454 -0.261 0 CA-C-O 120.929 0.395 . . . . 0.0 110.767 -179.682 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.744 HD21 ' CB ' ' A' ' 36' ' ' ALA . 4.0 tt -80.09 -47.73 14.35 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.643 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.454 ' N ' HD23 ' A' ' 9' ' ' LEU . 3.7 mtmp? -54.18 -32.68 56.18 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.562 179.641 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.429 ' O ' ' HG2' ' A' ' 14' ' ' GLU . 0.8 OUTLIER -87.7 -32.94 18.93 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.55 179.551 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.62 -36.75 76.95 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.269 179.368 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.637 ' HB3' HG11 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -85.04 -37.99 19.71 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.592 179.406 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.489 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 4.5 pt-20 -56.36 -49.56 74.07 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 178.902 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.424 ' N ' ' CG ' ' A' ' 14' ' ' GLU . 60.4 tt0 -63.38 -34.01 76.8 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 177.64 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.605 ' HB1' ' CD1' ' A' ' 33' ' ' ILE . . . -63.71 -39.53 94.52 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 115.143 -0.935 . . . . 0.0 109.968 179.073 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.773 ' O ' HG23 ' A' ' 21' ' ' VAL . 28.8 mm -55.61 -49.69 72.12 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.2 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 178.523 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.6 -32.15 70.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.304 -0.862 . . . . 0.0 109.695 178.399 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.648 ' CG ' HD13 ' A' ' 50' ' ' LEU . 0.2 OUTLIER -65.97 -52.47 49.29 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.637 179.533 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.733 HD22 ' HB ' ' A' ' 30' ' ' ILE . 0.3 OUTLIER -71.74 -32.97 68.31 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.392 179.768 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.773 HG23 ' O ' ' A' ' 17' ' ' ILE . 65.4 t -63.87 -31.44 53.18 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.207 0 CA-C-N 116.311 -0.404 . . . . 0.0 109.973 179.113 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -85.19 -38.4 19.03 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.946 179.199 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.754 ' CB ' HD11 ' A' ' 25' ' ' ILE . . . -76.1 -15.09 60.16 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.968 179.267 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.412 ' C ' HG13 ' A' ' 25' ' ' ILE . . . 39.81 89.8 0.01 OUTLIER Glycine 0 CA--C 1.523 0.552 0 CA-C-N 116.144 -0.48 . . . . 0.0 114.243 179.019 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.754 HD11 ' CB ' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -153.43 -167.65 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.268 0 CA-C-N 116.78 0.29 . . . . 0.0 110.702 179.028 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.446 ' HB3' ' CE2' ' A' ' 29' ' ' TYR . . . -46.65 97.22 0.01 OUTLIER 'General case' 0 C--O 1.232 0.149 0 CA-C-O 120.927 0.394 . . . . 0.0 111.344 -179.6 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.588 ' O ' HG22 ' A' ' 30' ' ' ILE . 0.2 OUTLIER -45.28 -25.43 0.38 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.268 179.574 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -40.95 -48.23 3.13 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 121.436 0.636 . . . . 0.0 110.839 179.463 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.594 ' HA ' ' HG ' ' A' ' 32' ' ' LEU . 58.1 m-85 -60.63 -33.65 73.09 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.14 179.87 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.733 ' HB ' HD22 ' A' ' 20' ' ' LEU . 1.8 tt -60.39 -26.29 36.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.641 -0.709 . . . . 0.0 109.676 178.392 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.32 -36.88 58.07 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.761 179.598 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.617 HD12 HD12 ' A' ' 45' ' ' LEU . 0.1 OUTLIER -58.88 -33.9 71.03 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 120.229 -0.588 . . . . 0.0 109.634 179.315 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.605 ' CD1' ' HB1' ' A' ' 16' ' ' ALA . 2.5 pt -91.75 -46.43 14.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.723 179.266 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -58.44 -29.5 66.18 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.757 -179.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 25.6 t30 -84.95 -16.32 41.39 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.015 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.744 ' CB ' HD21 ' A' ' 9' ' ' LEU . . . 59.07 -136.93 0.81 Allowed 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.137 179.505 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.539 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 25.0 tttt 95.29 -27.32 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 122.851 0.46 . . . . 0.0 110.667 -179.478 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.66 ' O ' HG23 ' A' ' 42' ' ' VAL . 60.1 p -142.25 83.68 1.84 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.332 179.522 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.533 HG13 ' N ' ' A' ' 40' ' ' GLU . 8.6 p -39.57 -49.45 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.566 -179.726 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.533 ' N ' HG13 ' A' ' 39' ' ' VAL . 0.1 OUTLIER -61.62 -43.17 99.35 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.873 -0.418 . . . . 0.0 109.873 179.289 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -65.75 -46.13 84.94 Favored Glycine 0 N--CA 1.447 -0.568 0 C-N-CA 120.447 -0.883 . . . . 0.0 111.724 178.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.66 HG23 ' O ' ' A' ' 38' ' ' THR . 14.6 t -45.44 -41.6 3.09 Favored 'Isoleucine or valine' 0 C--O 1.233 0.217 0 CA-C-O 121.126 0.489 . . . . 0.0 110.261 179.048 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 69.1 t90 -77.2 -30.57 54.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.0 179.382 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.4 m -79.39 -49.15 12.8 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 120.804 0.335 . . . . 0.0 110.91 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.759 ' O ' HG22 ' A' ' 49' ' ' ILE . 3.5 mm? -56.78 -36.03 69.38 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.239 179.4 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.521 ' HD3' ' HB2' ' A' ' 16' ' ' ALA . 15.5 ttpp -67.83 -58.85 3.89 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.604 179.523 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.48 -32.37 68.7 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.293 179.789 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 17.1 tt0 -77.22 -53.52 7.63 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.981 179.815 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.759 HG22 ' O ' ' A' ' 45' ' ' LEU . 3.6 tp -56.61 -23.97 18.26 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.289 0 C-N-CA 120.902 -0.319 . . . . 0.0 111.217 -179.773 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.648 HD13 ' CG ' ' A' ' 19' ' ' GLU . 1.8 tp -81.65 -33.32 31.41 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 178.766 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.435 ' HA ' ' CG2' ' A' ' 54' ' ' VAL . 17.1 m -64.43 -18.52 64.81 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.66 179.41 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.574 ' CD1' ' O ' ' A' ' 49' ' ' ILE . 0.0 OUTLIER -88.19 36.02 0.77 Allowed 'General case' 0 CA--C 1.531 0.223 0 CA-C-O 121.338 0.589 . . . . 0.0 111.361 -179.709 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.417 ' OG1' ' O ' ' A' ' 52' ' ' PHE . 2.4 m 176.25 -67.9 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.09 179.418 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.542 HG23 ' O ' ' A' ' 50' ' ' LEU . 70.9 t 53.44 102.35 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 CA-C-N 115.736 -0.666 . . . . 0.0 111.46 179.254 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -75.52 113.8 13.34 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.662 -179.771 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 . . . . . 0 C--O 1.249 1.079 0 CA-C-O 118.25 -0.881 . . . . 0.0 110.87 -179.983 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 7.5 t . . . . . 0 N--CA 1.486 1.329 0 CA-C-O 120.711 0.291 . . . . 0.0 111.144 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.4 ' OG1' HD11 ' A' ' 5' ' ' LEU . 0.6 OUTLIER -147.18 129.88 16.06 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-O 120.999 0.428 . . . . 0.0 110.895 -179.869 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 47.5 p90 -98.43 40.56 1.18 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.842 -179.763 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -151.3 73.33 1.09 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.987 -179.762 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.4 HD11 ' OG1' ' A' ' 2' ' ' THR . 2.5 mp -143.5 -45.91 0.28 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.949 179.816 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 1.1 pt -79.96 143.99 11.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 121.087 0.47 . . . . 0.0 110.911 -179.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.645 ' CD2' HG21 ' A' ' 39' ' ' VAL . 0.8 OUTLIER -171.11 -170.83 0.89 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.891 -179.857 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . 0.436 ' O ' ' HB2' ' A' ' 12' ' ' ALA . 1.8 t-20 -152.95 36.12 0.48 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.673 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.728 HD21 ' CB ' ' A' ' 36' ' ' ALA . 6.8 tt -84.82 -48.46 9.34 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.118 -179.595 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.425 ' HA ' ' HD3' ' A' ' 13' ' ' LYS . 45.9 tttp -52.79 -35.34 56.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.901 179.874 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.406 ' O ' ' HG3' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -87.37 -32.85 19.37 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.62 179.825 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.436 ' HB2' ' O ' ' A' ' 8' ' ' ASN . . . -58.91 -37.99 77.91 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.314 179.344 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.664 ' HB3' HG11 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -85.38 -35.4 21.38 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.784 -0.643 . . . . 0.0 111.021 179.754 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.619 ' O ' HG22 ' A' ' 17' ' ' ILE . 0.3 OUTLIER -58.52 -42.18 87.12 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 121.505 0.669 . . . . 0.0 109.299 179.086 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -72.75 -31.1 64.67 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.311 -0.859 . . . . 0.0 108.89 177.864 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.691 ' HB1' ' CD1' ' A' ' 33' ' ' ILE . . . -69.63 -42.44 74.32 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.184 -0.917 . . . . 0.0 111.335 179.903 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.683 ' O ' HG23 ' A' ' 21' ' ' VAL . 2.2 tp -61.6 -37.35 77.69 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.243 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 179.085 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.64 -32.46 71.16 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 177.491 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.59 ' CG ' HD13 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -62.03 -52.68 63.0 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.999 179.479 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.506 ' HG ' HG13 ' A' ' 25' ' ' ILE . 0.2 OUTLIER -74.95 -35.02 62.13 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.133 -179.442 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.683 HG23 ' O ' ' A' ' 17' ' ' ILE . 41.8 t -63.58 -31.25 52.24 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-O 120.838 0.351 . . . . 0.0 110.284 179.493 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -91.69 -33.12 15.18 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.638 179.571 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.77 ' HB1' HG21 ' A' ' 53' ' ' THR . . . -82.48 -15.05 53.91 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.579 179.858 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.714 ' O ' HG23 ' A' ' 25' ' ' ILE . . . 48.76 105.02 0.01 OUTLIER Glycine 0 CA--C 1.524 0.643 0 C-N-CA 121.136 -0.554 . . . . 0.0 113.104 179.607 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.714 HG23 ' O ' ' A' ' 24' ' ' GLY . 0.7 OUTLIER -177.43 -173.67 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.199 0 CA-C-N 117.213 0.506 . . . . 0.0 111.709 179.715 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -37.03 95.15 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 115.964 -0.562 . . . . 0.0 112.358 -179.15 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.438 ' O ' ' N ' ' A' ' 30' ' ' ILE . 9.8 tt0 -54.92 -25.36 28.76 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.559 179.143 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.8 tptm -44.63 -47.94 10.46 Favored 'General case' 0 C--O 1.239 0.51 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.699 179.389 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.611 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 2.7 m-85 -64.34 -30.39 71.44 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.278 0.561 . . . . 0.0 109.855 179.582 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.63 ' CD1' HD12 ' A' ' 17' ' ' ILE . 0.6 OUTLIER -61.58 -26.4 39.51 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 CA-C-N 115.846 -0.615 . . . . 0.0 109.402 178.056 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -75.88 -38.06 58.25 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.73 179.524 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.735 ' HB2' HD13 ' A' ' 45' ' ' LEU . 0.0 OUTLIER -61.02 -32.0 71.61 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 119.962 -0.695 . . . . 0.0 109.876 179.528 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.691 ' CD1' ' HB1' ' A' ' 16' ' ' ALA . 4.1 pt -91.7 -46.47 14.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.986 179.334 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -58.74 -29.03 66.41 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.807 -179.735 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -89.15 -16.43 31.42 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.963 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.728 ' CB ' HD21 ' A' ' 9' ' ' LEU . . . 62.52 -139.98 0.42 Allowed 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 116.682 -0.236 . . . . 0.0 111.007 179.603 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.537 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 0.0 OUTLIER 95.83 -27.63 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 122.818 0.447 . . . . 0.0 110.712 -179.73 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.692 ' O ' HG23 ' A' ' 42' ' ' VAL . 0.2 OUTLIER -140.88 83.14 1.87 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.435 179.618 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.645 HG21 ' CD2' ' A' ' 7' ' ' LEU . 9.2 p -40.93 -48.64 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.4 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.501 -179.849 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.52 ' N ' HG13 ' A' ' 39' ' ' VAL . 0.6 OUTLIER -62.11 -41.11 97.89 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 179.533 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -67.7 -47.11 63.43 Favored Glycine 0 N--CA 1.448 -0.511 0 C-N-CA 120.483 -0.865 . . . . 0.0 111.84 178.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.692 HG23 ' O ' ' A' ' 38' ' ' THR . 7.4 t -45.12 -40.43 2.32 Favored 'Isoleucine or valine' 0 C--O 1.232 0.139 0 CA-C-O 121.23 0.538 . . . . 0.0 110.198 179.161 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 60.8 t-105 -77.98 -31.52 50.8 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.985 179.186 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.8 m -78.66 -53.7 6.89 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.867 0.365 . . . . 0.0 110.988 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.737 ' O ' HG22 ' A' ' 49' ' ' ILE . 3.3 mt -55.14 -34.47 63.79 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.307 179.66 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.434 ' HB2' ' HB2' ' A' ' 16' ' ' ALA . 4.9 tttm -67.48 -58.64 4.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.229 179.446 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -60.5 -30.16 69.54 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.392 179.792 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -78.5 -53.15 7.53 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.109 179.847 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.737 HG22 ' O ' ' A' ' 45' ' ' LEU . 4.4 tp -55.69 -24.14 15.96 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.122 0 C-N-CA 120.961 -0.296 . . . . 0.0 110.912 -179.906 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.59 HD13 ' CG ' ' A' ' 19' ' ' GLU . 0.7 OUTLIER -82.39 -33.45 28.71 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 178.523 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 24.2 m -59.21 -24.93 63.56 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.13 179.172 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.579 ' CG ' ' O ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -86.84 19.59 2.92 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-O 121.139 0.495 . . . . 0.0 111.078 179.94 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.77 HG21 ' HB1' ' A' ' 23' ' ' ALA . 5.3 t -148.12 53.96 1.03 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.049 0.452 . . . . 0.0 111.369 179.374 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 20.9 t -145.24 115.41 1.75 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.191 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -133.61 72.51 1.48 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.829 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.248 0.996 0 CA-C-O 118.089 -0.958 . . . . 0.0 110.959 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 74.5 p . . . . . 0 N--CA 1.49 1.563 0 CA-C-O 120.989 0.423 . . . . 0.0 111.197 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 1.6 p -76.3 -59.65 2.68 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.827 -179.638 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER 58.86 22.79 10.61 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.865 -179.913 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -169.89 103.03 0.31 Allowed 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.66 180.0 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.665 HD22 ' N ' ' A' ' 5' ' ' LEU . 1.2 mm? -98.95 113.27 25.35 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.07 0.462 . . . . 0.0 110.826 -179.391 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.598 HG22 ' O ' ' A' ' 6' ' ' ILE . 24.3 mt 69.63 9.48 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.453 -0.28 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.889 179.459 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 50.81 -169.0 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.701 0.286 . . . . 0.0 111.002 179.762 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -134.46 -49.68 0.78 Allowed 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 116.528 -0.306 . . . . 0.0 111.702 179.423 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.718 HD21 ' CB ' ' A' ' 36' ' ' ALA . 8.9 tt -52.19 -48.93 64.78 Favored 'General case' 0 N--CA 1.456 -0.132 0 CA-C-O 121.003 0.43 . . . . 0.0 111.272 179.738 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.471 ' HA ' ' HD3' ' A' ' 13' ' ' LYS . 1.3 ttpp -52.89 -35.32 57.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.957 -179.852 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.89 -29.15 19.84 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.872 -179.988 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.34 -37.59 87.87 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.143 179.374 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.573 ' HB3' HG11 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -85.42 -35.49 21.26 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.96 179.712 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.799 ' O ' HG22 ' A' ' 17' ' ' ILE . 0.3 OUTLIER -60.03 -44.91 94.3 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.43 0.633 . . . . 0.0 109.312 179.206 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.4 ' N ' ' HG3' ' A' ' 14' ' ' GLU . 0.9 OUTLIER -70.18 -31.05 68.34 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.531 -0.758 . . . . 0.0 109.05 177.967 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.567 ' HB1' ' CD1' ' A' ' 33' ' ' ILE . . . -71.19 -38.32 72.09 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.221 -0.9 . . . . 0.0 111.329 -179.886 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.799 HG22 ' O ' ' A' ' 14' ' ' GLU . 1.7 tp -63.51 -34.87 70.13 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.289 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 179.338 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.5 mmmp? -72.26 -32.32 66.55 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 109.082 -0.71 . . . . 0.0 109.082 177.667 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.511 ' HB3' HD13 ' A' ' 50' ' ' LEU . 0.5 OUTLIER -63.77 -52.72 59.08 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.22 -0.9 . . . . 0.0 111.076 179.745 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.704 HD22 ' HB ' ' A' ' 30' ' ' ILE . 0.2 OUTLIER -73.93 -35.82 64.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.212 -179.52 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.626 HG23 ' O ' ' A' ' 17' ' ' ILE . 33.0 t -63.29 -31.17 51.79 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-O 120.833 0.349 . . . . 0.0 110.32 179.552 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -90.04 -34.08 16.08 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.506 179.605 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.949 ' HB1' HG21 ' A' ' 53' ' ' THR . . . -80.23 -15.12 57.71 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.534 179.723 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.597 ' O ' HG23 ' A' ' 25' ' ' ILE . . . 46.09 94.81 0.01 OUTLIER Glycine 0 CA--C 1.522 0.471 0 C-N-CA 121.001 -0.619 . . . . 0.0 113.237 179.724 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.738 ' N ' HD13 ' A' ' 25' ' ' ILE . 0.1 OUTLIER -160.63 -172.15 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.333 -0.13 0 CA-C-N 116.752 0.276 . . . . 0.0 111.239 179.87 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -41.47 94.75 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.948 -179.607 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.567 ' O ' HG22 ' A' ' 30' ' ' ILE . 0.0 OUTLIER -50.88 -25.61 4.76 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.623 179.59 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -45.89 -46.95 16.17 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-O 121.303 0.573 . . . . 0.0 110.548 179.195 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.68 ' HA ' ' HG ' ' A' ' 32' ' ' LEU . 3.0 m-85 -64.19 -29.78 70.87 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.279 0.562 . . . . 0.0 109.895 179.688 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.704 ' HB ' HD22 ' A' ' 20' ' ' LEU . 1.0 OUTLIER -62.38 -26.44 40.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.379 177.934 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -75.3 -36.05 61.19 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.403 179.373 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.68 ' HG ' ' HA ' ' A' ' 29' ' ' TYR . 0.2 OUTLIER -60.4 -34.66 74.24 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 120.263 -0.575 . . . . 0.0 109.826 179.146 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.567 ' CD1' ' HB1' ' A' ' 16' ' ' ALA . 5.5 pt -89.99 -46.33 15.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.943 179.414 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -61.11 -29.62 69.87 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.952 -179.46 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 33.1 t30 -84.99 -20.84 29.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.017 179.9 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.718 ' CB ' HD21 ' A' ' 9' ' ' LEU . . . 63.37 -140.01 0.35 Allowed 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.976 179.609 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.495 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 1.5 tpmp? 90.14 -22.38 0.11 Allowed 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 122.607 0.363 . . . . 0.0 111.221 -179.76 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.715 ' O ' HG23 ' A' ' 42' ' ' VAL . 0.8 OUTLIER -143.37 79.03 1.62 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.586 -0.279 . . . . 0.0 110.617 179.611 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.621 ' CA ' HD12 ' A' ' 9' ' ' LEU . 11.6 p -38.8 -49.05 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.445 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.767 -179.681 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.531 ' N ' HG13 ' A' ' 39' ' ' VAL . 0.2 OUTLIER -59.72 -47.53 85.27 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 179.511 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.47 ' O ' HD23 ' A' ' 45' ' ' LEU . . . -66.62 -40.25 94.02 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.412 -0.899 . . . . 0.0 112.452 179.269 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.715 HG23 ' O ' ' A' ' 38' ' ' THR . 21.4 t -47.07 -48.65 8.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 117.114 0.457 . . . . 0.0 110.56 179.627 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.467 ' CD1' ' HA ' ' A' ' 40' ' ' GLU . 15.4 p-90 -77.27 -26.16 52.15 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.444 179.617 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.8 m -79.68 -42.16 25.33 Favored 'General case' 0 N--CA 1.462 0.167 0 C-N-CA 120.599 -0.44 . . . . 0.0 110.983 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.725 ' O ' HG22 ' A' ' 49' ' ' ILE . 3.8 mm? -62.64 -33.77 75.71 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.133 -0.485 . . . . 0.0 109.846 179.405 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.463 ' HA ' HG22 ' A' ' 49' ' ' ILE . 8.6 ttpt -68.89 -62.12 1.52 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.229 179.292 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -55.7 -28.79 57.58 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.343 179.752 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -80.03 -54.72 5.52 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-N 115.828 -0.623 . . . . 0.0 110.713 179.589 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.725 HG22 ' O ' ' A' ' 45' ' ' LEU . 7.0 tp -58.69 -23.99 24.68 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.187 0 CA-C-O 120.86 0.362 . . . . 0.0 110.856 179.839 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.511 HD13 ' HB3' ' A' ' 19' ' ' GLU . 2.3 tp -80.3 -33.42 37.61 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.268 -0.642 . . . . 0.0 109.268 178.375 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 29.3 m -58.21 -29.71 65.91 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.783 179.085 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.627 ' HD1' ' O ' ' A' ' 49' ' ' ILE . 0.0 OUTLIER -82.3 12.28 4.56 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-O 120.89 0.376 . . . . 0.0 111.037 179.576 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.949 HG21 ' HB1' ' A' ' 23' ' ' ALA . 2.8 t -148.06 54.28 1.03 Allowed 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 121.204 0.526 . . . . 0.0 111.187 179.454 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.416 ' O ' ' N ' ' A' ' 56' ' ' GLU . 21.3 t -124.96 105.49 15.12 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.3 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.269 179.913 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.409 ' HG1' ' C ' ' A' ' 54' ' ' VAL . 3.2 p 52.12 -86.81 0.01 OUTLIER 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.449 -179.6 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.416 ' N ' ' O ' ' A' ' 54' ' ' VAL . 2.4 mt-10 . . . . . 0 C--O 1.25 1.111 0 CA-C-O 118.191 -0.909 . . . . 0.0 110.881 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . 0.433 ' O ' HG23 ' A' ' 2' ' ' THR . 19.6 m . . . . . 0 N--CA 1.485 1.285 0 CA-C-O 120.952 0.406 . . . . 0.0 111.052 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.433 HG23 ' O ' ' A' ' 1' ' ' THR . 0.1 OUTLIER -167.74 -57.34 0.02 OUTLIER 'General case' 0 C--O 1.235 0.294 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.438 -179.883 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER 57.64 22.85 8.71 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.739 -179.79 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 5.1 ttpt -159.28 -44.67 0.05 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.924 179.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.3 mp 63.61 141.9 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.365 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.509 ' O ' ' HB2' ' A' ' 7' ' ' LEU . 0.9 OUTLIER -179.91 -42.95 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.135 179.767 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.773 ' HB3' HG21 ' A' ' 39' ' ' VAL . 2.8 mm? 75.26 -16.89 0.54 Allowed 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 115.767 -0.651 . . . . 0.0 112.47 179.8 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . 0.543 ' O ' ' HB2' ' A' ' 12' ' ' ALA . 0.8 OUTLIER 79.78 34.91 0.16 Allowed 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 121.289 0.566 . . . . 0.0 110.062 -179.444 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 1.057 HD23 HG21 ' A' ' 42' ' ' VAL . 0.1 OUTLIER -85.16 -48.74 8.85 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.696 -179.704 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.817 ' N ' HD13 ' A' ' 9' ' ' LEU . 0.0 OUTLIER -56.82 -35.29 68.61 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.017 -179.969 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.3 -38.07 16.6 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.937 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.543 ' HB2' ' O ' ' A' ' 8' ' ' ASN . . . -56.37 -37.42 70.04 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.645 179.623 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.666 ' HB3' HG11 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -85.19 -35.38 21.69 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.679 179.587 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.454 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 3.0 mm-40 -59.44 -50.43 73.97 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 179.059 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -63.77 -36.83 85.19 Favored 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 108.925 -0.768 . . . . 0.0 108.925 178.033 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.541 ' HB1' HD13 ' A' ' 33' ' ' ILE . . . -64.21 -35.04 79.5 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-N 115.092 -0.958 . . . . 0.0 110.346 179.483 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.82 ' O ' HG23 ' A' ' 21' ' ' VAL . 1.4 mp -58.62 -47.44 88.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 178.965 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 4.6 mmmt -63.13 -33.12 74.77 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.936 178.59 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.611 ' HB3' HD13 ' A' ' 50' ' ' LEU . 0.2 OUTLIER -57.77 -52.49 65.25 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.873 179.618 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.956 HD22 HG13 ' A' ' 30' ' ' ILE . 0.2 OUTLIER -76.06 -30.63 58.44 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.703 -0.399 . . . . 0.0 110.37 179.77 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.82 HG23 ' O ' ' A' ' 17' ' ' ILE . 53.1 t -62.76 -31.28 51.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 178.733 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -86.91 -39.89 15.34 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.878 178.975 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.804 ' CB ' HD11 ' A' ' 25' ' ' ILE . . . -73.91 -15.05 61.15 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.795 179.033 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.424 ' C ' HG13 ' A' ' 25' ' ' ILE . . . 43.48 77.69 0.08 OUTLIER Glycine 0 C--N 1.333 0.396 0 CA-C-N 116.013 -0.539 . . . . 0.0 114.224 179.136 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.804 HD11 ' CB ' ' A' ' 23' ' ' ALA . 0.2 OUTLIER -141.83 -171.74 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.246 0 CA-C-O 120.734 0.302 . . . . 0.0 110.785 178.745 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.536 ' H ' HG22 ' A' ' 25' ' ' ILE . . . -44.57 97.64 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.676 -179.477 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.489 ' O ' ' N ' ' A' ' 30' ' ' ILE . 10.5 pt-20 -45.85 -25.23 0.49 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.16 179.187 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -41.29 -47.61 3.47 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 121.45 0.643 . . . . 0.0 110.8 179.456 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.594 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 63.3 m-85 -59.3 -32.39 70.01 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.336 179.909 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.956 HG13 HD22 ' A' ' 20' ' ' LEU . 25.8 mt -62.21 -26.64 40.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.464 177.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 6.3 tttm -74.29 -36.1 63.75 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.61 179.662 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.594 ' HG ' ' O ' ' A' ' 29' ' ' TYR . 0.1 OUTLIER -61.51 -33.97 74.71 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 120.216 -0.594 . . . . 0.0 109.815 179.353 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.552 HG22 ' HA ' ' A' ' 42' ' ' VAL . 2.4 pt -91.91 -44.71 14.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.046 179.408 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.421 ' CB ' ' O ' ' A' ' 30' ' ' ILE . . . -61.1 -30.99 70.69 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.079 -179.651 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 23.6 t30 -81.57 -3.05 52.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.114 -179.858 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.78 ' CB ' HD21 ' A' ' 9' ' ' LEU . . . 49.92 -131.04 1.95 Allowed 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 116.549 -0.296 . . . . 0.0 111.242 179.465 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.416 ' HB2' ' O ' ' A' ' 36' ' ' ALA . 0.0 OUTLIER 76.16 -5.65 2.14 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 179.937 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.714 ' O ' HG23 ' A' ' 42' ' ' VAL . 0.6 OUTLIER -159.9 71.41 0.47 Allowed 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 110.287 -0.264 . . . . 0.0 110.287 179.684 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.773 HG21 ' HB3' ' A' ' 7' ' ' LEU . 11.9 p -38.69 -50.63 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.906 -179.564 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.542 ' N ' HG13 ' A' ' 39' ' ' VAL . 2.1 mm-40 -61.05 -43.28 99.12 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 109.954 -0.388 . . . . 0.0 109.954 179.321 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.43 ' O ' ' HG ' ' A' ' 45' ' ' LEU . . . -66.9 -45.69 81.07 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.474 -0.869 . . . . 0.0 111.902 178.846 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 1.057 HG21 HD23 ' A' ' 9' ' ' LEU . 15.5 t -45.94 -39.36 3.17 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.111 0 CA-C-O 121.208 0.528 . . . . 0.0 110.352 179.141 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 45.9 t-105 -78.3 -32.06 49.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.586 179.004 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.408 ' HA ' ' OD2' ' A' ' 47' ' ' ASP . 1.3 m -77.74 -50.99 11.26 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.982 179.89 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.77 ' O ' HG22 ' A' ' 49' ' ' ILE . 0.9 OUTLIER -56.9 -34.51 67.98 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.314 179.543 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.464 ' CD ' ' HB2' ' A' ' 16' ' ' ALA . 11.3 ttpp -67.52 -58.42 4.74 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.633 179.877 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.408 ' OD2' ' HA ' ' A' ' 44' ' ' THR . 4.7 p30 -62.64 -27.43 69.21 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.362 -179.928 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -79.98 -51.29 9.25 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.74 179.64 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.77 HG22 ' O ' ' A' ' 45' ' ' LEU . 3.8 tp -57.49 -24.24 21.5 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 C-N-CA 120.741 -0.383 . . . . 0.0 110.917 179.997 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.611 HD13 ' HB3' ' A' ' 19' ' ' GLU . 2.3 tp -82.05 -35.15 29.06 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 178.89 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 10.8 m -65.22 -14.52 60.86 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 115.602 -0.726 . . . . 0.0 111.677 179.49 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.564 ' CG ' ' O ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -91.2 30.81 1.19 Allowed 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 121.288 0.566 . . . . 0.0 111.551 -179.498 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.644 ' O ' HG22 ' A' ' 53' ' ' THR . 7.5 m -174.83 70.77 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.46 179.147 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.436 HG22 ' N ' ' A' ' 55' ' ' THR . 9.1 p -157.56 156.48 4.21 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.526 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.628 -179.762 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.436 ' N ' HG22 ' A' ' 54' ' ' VAL . 0.2 OUTLIER -59.48 -68.29 0.29 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.915 -179.809 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.395 -0.812 . . . . 0.0 110.803 -179.864 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . 0.595 ' O ' HG23 ' A' ' 2' ' ' THR . 4.1 p . . . . . 0 N--CA 1.486 1.34 0 CA-C-O 120.656 0.265 . . . . 0.0 111.468 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.595 HG23 ' O ' ' A' ' 1' ' ' THR . 4.5 p -161.96 131.33 4.51 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.06 0.457 . . . . 0.0 110.744 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . 0.589 ' CD1' HD21 ' A' ' 5' ' ' LEU . 1.1 t80 -81.22 -9.33 59.8 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.195 179.878 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.536 ' HG3' ' C ' ' A' ' 3' ' ' TYR . 0.0 OUTLIER 33.49 75.07 0.05 Allowed 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 179.798 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.589 HD21 ' CD1' ' A' ' 3' ' ' TYR . 0.7 OUTLIER -109.69 -65.7 1.13 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.195 0.521 . . . . 0.0 110.676 179.368 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.422 HG22 ' O ' ' A' ' 6' ' ' ILE . 19.1 mt 70.05 52.58 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.181 179.836 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.484 HD23 ' HB3' ' A' ' 5' ' ' LEU . 3.2 pp -128.83 1.82 5.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.78 179.763 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 3.9 p30 -156.6 36.17 0.31 Allowed 'General case' 0 C--O 1.232 0.14 0 CA-C-O 120.799 0.333 . . . . 0.0 111.122 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.713 HD21 ' CB ' ' A' ' 36' ' ' ALA . 6.8 tt -85.36 -48.19 9.28 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.12 -179.742 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.494 ' HA ' ' HD3' ' A' ' 13' ' ' LYS . 3.7 tttt -52.56 -31.54 36.46 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.628 179.904 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 13.7 tt0 -87.61 -37.73 16.55 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.565 179.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -55.86 -38.18 69.77 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.519 179.473 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.652 ' HB3' HG11 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -85.05 -35.31 21.96 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.6 179.692 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.776 ' O ' HG22 ' A' ' 17' ' ' ILE . 2.3 mm-40 -58.09 -50.04 74.85 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 178.707 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -65.13 -31.05 72.05 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 177.84 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.696 ' HB1' ' CD1' ' A' ' 33' ' ' ILE . . . -68.22 -43.45 77.94 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 115.215 -0.902 . . . . 0.0 111.663 -179.838 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.776 HG22 ' O ' ' A' ' 14' ' ' GLU . 8.4 tp -60.31 -35.5 62.78 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.265 0 C-N-CA 120.645 -0.422 . . . . 0.0 109.875 179.933 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.84 -32.21 65.31 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 177.887 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.696 ' CG ' HD13 ' A' ' 50' ' ' LEU . 0.3 OUTLIER -62.2 -52.7 62.73 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.176 -0.92 . . . . 0.0 111.753 -179.797 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.803 HD22 HG13 ' A' ' 30' ' ' ILE . 0.2 OUTLIER -76.82 -34.45 57.9 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.878 -0.329 . . . . 0.0 110.99 -179.612 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.611 HG23 ' O ' ' A' ' 17' ' ' ILE . 24.1 t -61.55 -31.13 49.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 120.885 0.374 . . . . 0.0 110.199 179.386 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -90.3 -36.61 14.59 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.31 179.306 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -78.16 -14.95 59.26 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.19 179.603 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.423 ' N ' ' O ' ' A' ' 20' ' ' LEU . . . 50.47 105.3 0.01 OUTLIER Glycine 0 CA--C 1.522 0.504 0 C-N-CA 121.252 -0.499 . . . . 0.0 113.291 179.491 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.538 HG21 ' CE1' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -174.76 -171.94 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.377 0 CA-C-N 117.185 0.492 . . . . 0.0 111.678 179.397 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -40.85 95.94 0.01 OUTLIER 'General case' 0 C--O 1.232 0.14 0 CA-C-N 115.911 -0.586 . . . . 0.0 112.213 -179.186 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.428 ' O ' ' N ' ' A' ' 30' ' ' ILE . 21.3 mt-10 -53.0 -25.63 12.71 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.544 179.122 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.7 tptm -46.06 -45.54 16.19 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.388 179.152 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.783 ' CG ' HD13 ' A' ' 49' ' ' ILE . 2.8 m-85 -61.37 -30.52 70.59 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.041 179.585 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.803 HG13 HD22 ' A' ' 20' ' ' LEU . 40.9 mt -62.24 -26.67 40.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 177.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.407 ' O ' ' HB3' ' A' ' 35' ' ' ASN . 2.8 tttp -74.12 -37.13 64.19 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.629 179.386 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.587 ' HG ' ' O ' ' A' ' 29' ' ' TYR . 0.1 OUTLIER -62.38 -32.74 73.59 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 120.191 -0.604 . . . . 0.0 109.962 179.527 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.696 ' CD1' ' HB1' ' A' ' 16' ' ' ALA . 4.0 pt -91.85 -46.3 14.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.105 179.517 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.405 ' CB ' ' O ' ' A' ' 30' ' ' ILE . . . -60.64 -30.53 69.93 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.906 -179.576 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.407 ' HB3' ' O ' ' A' ' 31' ' ' LYS . 34.1 t30 -83.48 -14.05 53.28 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.83 179.868 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.713 ' CB ' HD21 ' A' ' 9' ' ' LEU . . . 57.61 -138.74 0.88 Allowed 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.124 179.429 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.484 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 0.0 OUTLIER 89.07 -21.5 0.14 Allowed 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 122.582 0.353 . . . . 0.0 111.131 -179.54 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.727 ' O ' HG23 ' A' ' 42' ' ' VAL . 1.5 m -143.22 78.57 1.61 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.49 179.579 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.514 HG13 ' N ' ' A' ' 40' ' ' GLU . 7.8 p -40.51 -49.07 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.396 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.714 -179.642 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.514 ' N ' HG13 ' A' ' 39' ' ' VAL . 2.5 mt-10 -60.68 -43.22 97.97 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 179.421 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.421 ' O ' ' HG ' ' A' ' 45' ' ' LEU . . . -67.5 -47.88 60.21 Favored Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.55 -0.833 . . . . 0.0 111.935 179.073 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.727 HG23 ' O ' ' A' ' 38' ' ' THR . 8.8 t -43.58 -41.47 1.47 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.226 0 CA-C-O 121.188 0.518 . . . . 0.0 110.366 179.213 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 2.4 t-105 -78.38 -32.07 48.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.178 179.391 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.8 m -79.28 -48.85 13.41 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 120.782 0.325 . . . . 0.0 110.993 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.69 ' O ' HG22 ' A' ' 49' ' ' ILE . 1.8 mt -56.92 -36.87 70.71 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.056 179.569 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.572 ' HD3' ' HB2' ' A' ' 16' ' ' ALA . 7.4 ttpt -66.65 -60.2 2.92 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.486 179.309 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -57.71 -33.23 68.2 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.574 -179.916 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -76.35 -52.71 9.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.999 179.866 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.783 HD13 ' CG ' ' A' ' 29' ' ' TYR . 9.4 tp -59.43 -24.32 27.86 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.214 -179.83 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.696 HD13 ' CG ' ' A' ' 19' ' ' GLU . 3.2 tp -79.37 -34.34 42.09 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 178.741 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 23.0 m -59.04 -35.71 73.77 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.88 179.376 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.79 ' CG ' ' O ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -72.05 55.95 0.31 Allowed 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 121.447 0.642 . . . . 0.0 110.38 179.886 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.2 m 165.66 -62.87 0.0 OUTLIER 'General case' 0 N--CA 1.46 0.033 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 -179.885 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 2.9 t -93.28 85.4 1.99 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.963 179.434 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -58.22 126.33 27.04 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 120.912 0.387 . . . . 0.0 110.671 -179.65 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.252 1.212 0 CA-C-O 118.387 -0.816 . . . . 0.0 110.993 179.737 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 3.0 m . . . . . 0 N--CA 1.48 1.038 0 CA-C-O 120.496 0.188 . . . . 0.0 111.432 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.552 ' OG1' HD11 ' A' ' 5' ' ' LEU . 19.2 p -86.32 142.82 28.23 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.319 179.757 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 30.9 p90 -113.8 32.51 5.79 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.98 -179.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.486 ' C ' HD12 ' A' ' 5' ' ' LEU . 0.0 OUTLIER -155.18 105.35 2.51 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.907 0.384 . . . . 0.0 110.749 -179.722 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.552 HD11 ' OG1' ' A' ' 2' ' ' THR . 4.9 mp -153.04 101.16 2.55 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.954 179.9 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 1.8 tt -46.52 -29.1 1.04 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.84 179.917 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 26.4 tp -132.36 144.96 50.9 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.538 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . 0.578 ' O ' ' HB2' ' A' ' 12' ' ' ALA . 13.8 t-20 -158.9 41.06 0.23 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.053 -179.725 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 1.05 HD23 HG21 ' A' ' 42' ' ' VAL . 0.2 OUTLIER -82.52 -48.86 10.53 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.98 0.419 . . . . 0.0 110.518 179.841 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.685 ' N ' HD13 ' A' ' 9' ' ' LEU . 35.7 mttt -59.38 -33.72 71.54 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.832 179.868 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.43 ' O ' ' HG2' ' A' ' 14' ' ' GLU . 2.3 mp0 -88.15 -36.55 16.78 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.056 -179.86 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.578 ' HB2' ' O ' ' A' ' 8' ' ' ASN . . . -57.41 -37.23 72.42 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.84 0.352 . . . . 0.0 110.334 179.511 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.57 ' HB3' HG11 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -84.92 -37.38 20.61 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.773 179.678 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.477 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 4.1 pt-20 -56.56 -49.37 75.03 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 109.141 -0.688 . . . . 0.0 109.141 178.875 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.441 ' N ' ' CG ' ' A' ' 14' ' ' GLU . 0.8 OUTLIER -65.01 -31.54 72.83 Favored 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 108.774 -0.824 . . . . 0.0 108.774 177.738 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.703 ' HB1' ' CD1' ' A' ' 33' ' ' ILE . . . -65.09 -43.38 92.31 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.59 179.267 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.71 ' O ' HG23 ' A' ' 21' ' ' VAL . 37.1 mm -55.83 -48.26 78.5 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.207 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 178.771 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.6 pttt -60.98 -32.38 71.94 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.562 178.37 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.555 ' CG ' HD13 ' A' ' 50' ' ' LEU . 0.2 OUTLIER -65.76 -52.35 51.71 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.701 179.496 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.742 HD22 ' HB ' ' A' ' 30' ' ' ILE . 0.2 OUTLIER -73.55 -33.94 64.95 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.685 179.965 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.71 HG23 ' O ' ' A' ' 17' ' ' ILE . 54.4 t -64.64 -31.26 52.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 120.92 0.391 . . . . 0.0 110.169 179.219 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -88.77 -34.59 17.06 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.283 179.478 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.85 ' HB3' HD11 ' A' ' 25' ' ' ILE . . . -81.1 -15.22 56.55 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.313 179.505 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 41.73 82.67 0.02 OUTLIER Glycine 0 C--N 1.334 0.433 0 CA-C-N 116.216 -0.447 . . . . 0.0 113.846 179.362 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.85 HD11 ' HB3' ' A' ' 23' ' ' ALA . 0.1 OUTLIER -146.38 -163.3 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.219 0 CA-C-N 116.709 0.254 . . . . 0.0 110.909 179.397 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -43.89 95.3 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 120.782 0.325 . . . . 0.0 111.85 -179.447 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.626 ' O ' HG22 ' A' ' 30' ' ' ILE . 0.3 OUTLIER -52.18 -26.28 11.17 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.952 0.406 . . . . 0.0 110.561 179.415 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.5 tptm -46.69 -45.7 19.62 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-O 121.277 0.561 . . . . 0.0 110.319 179.135 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.788 ' CG ' HD13 ' A' ' 49' ' ' ILE . 3.6 m-85 -62.72 -31.01 71.85 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.878 179.558 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.742 ' HB ' HD22 ' A' ' 20' ' ' LEU . 1.6 tt -61.56 -26.51 39.8 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.627 178.322 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.03 -37.45 58.35 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.735 179.634 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.591 ' HG ' ' HA ' ' A' ' 29' ' ' TYR . 0.1 OUTLIER -60.52 -32.76 71.78 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 120.123 -0.631 . . . . 0.0 109.966 179.415 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.703 ' CD1' ' HB1' ' A' ' 16' ' ' ALA . 3.7 pt -91.76 -47.22 14.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.923 179.442 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.41 ' HB2' HD11 ' A' ' 17' ' ' ILE . . . -59.05 -29.23 67.15 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.999 -179.558 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 -85.72 -11.35 53.88 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.26 -179.763 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.632 ' CB ' HD21 ' A' ' 9' ' ' LEU . . . 56.88 -141.2 0.81 Allowed 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 116.774 -0.194 . . . . 0.0 111.065 179.615 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.484 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 0.0 OUTLIER 89.45 -21.33 0.14 Allowed 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 122.629 0.372 . . . . 0.0 111.34 179.978 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.892 ' O ' HG23 ' A' ' 42' ' ' VAL . 9.9 m -144.05 77.72 1.56 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.676 0.274 . . . . 0.0 110.55 179.791 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.529 HG13 ' N ' ' A' ' 40' ' ' GLU . 14.5 p -38.85 -48.44 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.405 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.703 -179.878 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.529 ' N ' HG13 ' A' ' 39' ' ' VAL . 1.8 tt0 -61.39 -52.86 62.84 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.153 179.569 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.753 ' H ' HG22 ' A' ' 38' ' ' THR . . . -61.79 -38.47 96.01 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.323 -0.942 . . . . 0.0 112.158 179.188 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 1.05 HG21 HD23 ' A' ' 9' ' ' LEU . 22.8 t -49.24 -45.32 17.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.938 0.399 . . . . 0.0 110.503 179.372 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.486 ' CZ2' ' HA ' ' A' ' 40' ' ' GLU . 1.1 p90 -79.04 -25.66 43.18 Favored 'General case' 0 N--CA 1.457 -0.121 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.028 179.308 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.422 ' N ' ' CD1' ' A' ' 43' ' ' TRP . 1.3 m -79.3 -47.53 15.7 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-O 120.885 0.374 . . . . 0.0 110.862 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.69 ' O ' HG22 ' A' ' 49' ' ' ILE . 4.4 mm? -61.19 -33.54 73.62 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.01 179.527 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.566 ' HD3' ' HB2' ' A' ' 16' ' ' ALA . 17.5 ttpt -67.85 -59.6 3.17 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.395 179.422 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.52 -32.56 70.41 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.291 179.888 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -76.35 -51.95 10.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.97 179.84 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.788 HD13 ' CG ' ' A' ' 29' ' ' TYR . 8.6 tp -59.85 -23.86 27.79 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.243 0 C-N-CA 120.691 -0.403 . . . . 0.0 111.353 -179.804 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.555 HD13 ' CG ' ' A' ' 19' ' ' GLU . 3.2 tp -79.77 -34.62 39.63 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 178.802 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.461 ' HA ' ' CG2' ' A' ' 54' ' ' VAL . 9.3 m -67.21 -17.08 64.67 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.569 -0.741 . . . . 0.0 111.826 179.514 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.65 ' CE1' HG21 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -87.85 33.1 0.72 Allowed 'General case' 0 N--CA 1.462 0.162 0 CA-C-O 121.502 0.667 . . . . 0.0 111.074 179.964 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.48 ' O ' ' N ' ' A' ' 55' ' ' THR . 2.8 m 178.32 -70.65 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.137 -0.938 . . . . 0.0 108.894 179.599 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.498 HG23 ' O ' ' A' ' 50' ' ' LEU . 72.5 t 60.46 -69.93 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.462 0 CA-C-N 115.478 -0.783 . . . . 0.0 111.649 178.966 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.48 ' N ' ' O ' ' A' ' 53' ' ' THR . 86.3 m -127.5 -81.42 0.6 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.829 0.347 . . . . 0.0 110.82 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 . . . . . 0 C--O 1.247 0.946 0 CA-C-O 118.23 -0.891 . . . . 0.0 110.839 -179.828 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 35.3 p . . . . . 0 N--CA 1.488 1.431 0 CA-C-O 121.436 0.636 . . . . 0.0 111.046 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 40.0 p -115.87 -54.94 2.47 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.76 -179.766 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 58.17 22.0 8.64 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.086 179.908 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -165.46 83.77 0.35 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.171 0.51 . . . . 0.0 110.813 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.4 mt -119.49 169.5 9.99 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.837 -179.891 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.427 ' HB ' HD12 ' A' ' 7' ' ' LEU . 20.2 mt -76.89 -31.93 19.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 121.286 0.565 . . . . 0.0 111.246 179.938 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.657 ' HB3' HG21 ' A' ' 39' ' ' VAL . 3.7 mp -145.94 -41.86 0.21 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.192 -179.868 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . 0.559 ' CB ' ' O ' ' A' ' 7' ' ' LEU . 5.8 t-20 98.58 -0.53 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.502 0 O-C-N 123.643 0.589 . . . . 0.0 110.726 -179.58 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.735 HD21 ' HB2' ' A' ' 36' ' ' ALA . 7.4 tt -49.65 -47.72 49.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.275 179.511 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.489 ' HA ' ' HD3' ' A' ' 13' ' ' LYS . 0.8 OUTLIER -51.82 -32.6 32.31 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.745 179.962 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 2.6 tm0? -89.89 -29.14 18.75 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.879 179.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.97 -37.44 87.41 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.106 179.347 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.645 ' HB3' HG11 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -85.27 -35.39 21.56 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.862 179.66 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.72 ' O ' HG22 ' A' ' 17' ' ' ILE . 0.1 OUTLIER -61.21 -47.34 86.54 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 179.218 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -65.76 -34.19 77.61 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 177.913 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.523 ' HB1' ' CD1' ' A' ' 33' ' ' ILE . . . -68.33 -36.83 79.85 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.5 179.39 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.72 HG22 ' O ' ' A' ' 14' ' ' GLU . 1.1 tp -58.19 -35.89 55.09 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.249 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 179.286 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 19.8 mttt -75.11 -33.07 61.56 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.654 178.347 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.618 ' HB3' HD13 ' A' ' 50' ' ' LEU . 0.4 OUTLIER -62.2 -52.32 64.26 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.659 179.407 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.79 HD22 ' HB ' ' A' ' 30' ' ' ILE . 0.3 OUTLIER -69.93 -34.79 73.93 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.685 179.946 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.712 HG23 ' O ' ' A' ' 17' ' ' ILE . 37.7 t -64.78 -31.29 53.18 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.229 0 CA-C-O 120.937 0.399 . . . . 0.0 109.933 179.091 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -84.21 -38.09 21.01 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.031 179.15 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.748 ' HB3' HD11 ' A' ' 25' ' ' ILE . . . -76.79 -15.3 59.78 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.141 179.333 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.401 ' C ' HG13 ' A' ' 25' ' ' ILE . . . 41.18 90.07 0.01 OUTLIER Glycine 0 C--N 1.335 0.495 0 CA-C-N 116.211 -0.449 . . . . 0.0 113.856 179.258 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.748 HD11 ' HB3' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -155.51 -164.71 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.271 0 CA-C-O 120.713 0.292 . . . . 0.0 110.922 179.179 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.559 ' HB3' ' CD2' ' A' ' 29' ' ' TYR . . . -44.75 95.76 0.01 OUTLIER 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.844 -179.586 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.651 ' O ' HG22 ' A' ' 30' ' ' ILE . 53.2 mt-10 -48.42 -26.96 2.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.674 179.432 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 12.2 tptm -44.96 -45.45 10.53 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.504 179.274 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.615 ' HA ' ' HG ' ' A' ' 32' ' ' LEU . 75.8 m-85 -61.05 -32.52 72.15 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.422 0.629 . . . . 0.0 110.128 179.614 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.79 ' HB ' HD22 ' A' ' 20' ' ' LEU . 2.2 tt -61.9 -26.38 39.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.705 178.484 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.9 tppp? -75.68 -35.6 60.31 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.576 179.472 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.893 ' HB2' HD23 ' A' ' 45' ' ' LEU . 0.2 OUTLIER -59.77 -35.18 74.1 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 120.361 -0.536 . . . . 0.0 109.749 179.316 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.523 ' CD1' ' HB1' ' A' ' 16' ' ' ALA . 2.9 pt -90.76 -46.33 14.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.945 179.402 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -60.51 -28.82 68.68 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.086 -179.704 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 -84.41 -12.93 53.52 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.406 -179.7 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.735 ' HB2' HD21 ' A' ' 9' ' ' LEU . . . 62.7 -136.17 0.44 Allowed 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 116.86 -0.155 . . . . 0.0 110.84 179.61 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.489 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 0.0 OUTLIER 87.64 -14.86 0.42 Allowed 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 179.808 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.654 ' O ' HG23 ' A' ' 42' ' ' VAL . 5.5 t -158.82 79.17 0.78 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.868 0.366 . . . . 0.0 110.635 179.388 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.697 ' CA ' HD12 ' A' ' 9' ' ' LEU . 10.2 p -38.65 -49.97 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.483 0 CA-C-N 115.894 -0.593 . . . . 0.0 111.753 -179.794 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.548 ' N ' HG13 ' A' ' 39' ' ' VAL . 2.8 mt-10 -60.19 -43.09 96.19 Favored 'General case' 0 CA--C 1.52 -0.194 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 179.365 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.407 ' N ' ' O ' ' A' ' 38' ' ' THR . . . -67.66 -46.7 66.54 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.448 -0.882 . . . . 0.0 111.921 178.752 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.654 HG23 ' O ' ' A' ' 38' ' ' THR . 12.2 t -43.97 -40.99 1.65 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.197 0 CA-C-O 121.062 0.458 . . . . 0.0 110.399 179.339 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 4.6 t-105 -78.64 -32.26 47.27 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.163 179.39 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.6 m -79.14 -45.12 20.63 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.887 0.375 . . . . 0.0 110.913 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.893 HD23 ' HB2' ' A' ' 32' ' ' LEU . 0.4 OUTLIER -60.06 -34.98 74.16 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.894 179.546 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.452 ' HA ' HG22 ' A' ' 49' ' ' ILE . 9.7 ttpt -68.05 -61.04 2.04 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.366 179.409 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -57.03 -32.71 66.45 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.365 179.801 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -76.46 -52.82 9.09 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.811 179.772 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.727 HG22 ' O ' ' A' ' 45' ' ' LEU . 6.2 tp -59.39 -23.86 26.45 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.32 0 C-N-CA 120.759 -0.376 . . . . 0.0 111.179 -179.895 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.618 HD13 ' HB3' ' A' ' 19' ' ' GLU . 5.4 tp -79.57 -32.54 42.04 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.19 0.519 . . . . 0.0 109.613 178.856 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 16.3 m -68.31 -20.69 64.76 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.602 -0.726 . . . . 0.0 112.049 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.614 ' CG ' ' O ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -85.11 43.78 1.03 Allowed 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 121.635 0.731 . . . . 0.0 111.185 -179.74 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 5.7 m -176.18 -67.42 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.516 179.331 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 3.3 t -78.05 -71.28 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.607 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.544 179.875 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.06 101.57 0.22 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.983 0.421 . . . . 0.0 111.088 -179.759 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 . . . . . 0 C--O 1.246 0.892 0 CA-C-O 118.266 -0.874 . . . . 0.0 110.933 -179.961 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 3.0 m . . . . . 0 N--CA 1.486 1.36 0 CA-C-O 120.944 0.402 . . . . 0.0 111.188 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.471 HG21 HD21 ' A' ' 5' ' ' LEU . 34.9 p -126.89 -56.01 1.37 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.71 -179.927 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 1.2 t80 58.86 21.05 8.66 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.638 -179.449 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 5.1 ttpt -163.27 81.83 0.47 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.078 -179.86 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.471 HD21 HG21 ' A' ' 2' ' ' THR . 4.1 mt -129.93 -56.56 1.12 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.584 -179.704 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.614 HG23 ' HG3' ' A' ' 10' ' ' LYS . 20.1 mt -128.17 91.91 1.79 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.377 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.905 -179.956 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 4.0 tp -176.09 -38.08 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 120.618 0.247 . . . . 0.0 111.219 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . 0.779 ' ND2' HG21 ' A' ' 39' ' ' VAL . 5.8 p-10 -107.73 -53.05 2.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.88 0.371 . . . . 0.0 110.871 -179.86 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.951 ' CD1' HG21 ' A' ' 42' ' ' VAL . 1.3 tp -69.01 -48.99 61.67 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.815 179.85 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.614 ' HG3' HG23 ' A' ' 6' ' ' ILE . 0.7 OUTLIER -59.39 -34.61 72.65 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.864 -179.938 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -88.5 -30.91 19.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.782 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.472 ' HB2' ' O ' ' A' ' 8' ' ' ASN . . . -61.05 -37.75 83.75 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.085 179.321 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.613 ' HB3' HG11 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -85.03 -37.03 20.85 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.752 179.626 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.47 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 0.3 OUTLIER -58.45 -47.28 84.53 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 179.229 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -66.39 -33.11 74.97 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 177.837 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.609 ' HB1' ' CD1' ' A' ' 33' ' ' ILE . . . -64.0 -36.93 85.59 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.394 179.268 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.768 ' O ' HG23 ' A' ' 21' ' ' VAL . 4.9 mm -60.94 -50.95 78.45 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.337 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 178.697 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.29 -32.2 66.39 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.355 -0.839 . . . . 0.0 109.851 178.498 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.602 ' CG ' HD13 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -61.88 -52.47 63.99 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.081 179.694 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.863 HD22 HG13 ' A' ' 30' ' ' ILE . 0.2 OUTLIER -79.39 -29.58 42.13 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.756 -179.984 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.768 HG23 ' O ' ' A' ' 17' ' ' ILE . 65.0 t -64.91 -32.43 58.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.274 179.571 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -90.0 -38.11 13.85 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.035 179.232 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -76.24 -14.72 60.12 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.023 179.283 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 48.25 97.67 0.01 OUTLIER Glycine 0 C--N 1.332 0.344 0 C-N-CA 121.143 -0.551 . . . . 0.0 113.002 179.58 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.658 HG21 ' CE1' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -160.11 -166.64 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.26 0 CA-C-N 116.899 0.35 . . . . 0.0 111.125 179.734 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -47.76 94.56 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.85 -179.549 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.414 ' O ' ' N ' ' A' ' 30' ' ' ILE . 4.2 mm-40 -51.24 -26.9 7.85 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.069 0.461 . . . . 0.0 110.48 179.267 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -46.8 -44.81 19.53 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.065 178.926 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.757 ' CG ' HD13 ' A' ' 49' ' ' ILE . 3.5 m-85 -60.76 -31.72 71.06 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.067 179.5 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.863 HG13 HD22 ' A' ' 20' ' ' LEU . 43.2 mt -61.57 -26.53 39.85 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 CA-C-N 115.967 -0.56 . . . . 0.0 109.507 178.02 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.3 tttp -74.45 -35.92 63.35 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.477 179.399 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.902 ' HB2' HD23 ' A' ' 45' ' ' LEU . 0.2 OUTLIER -61.36 -33.83 74.3 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 120.377 -0.529 . . . . 0.0 109.93 179.464 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.609 ' CD1' ' HB1' ' A' ' 16' ' ' ALA . 2.3 pt -91.83 -46.65 14.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.831 179.506 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.402 ' CB ' ' O ' ' A' ' 30' ' ' ILE . . . -58.85 -29.56 67.03 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.889 -179.659 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 24.0 t30 -85.13 -7.07 59.24 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.218 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.798 ' HB1' HD21 ' A' ' 9' ' ' LEU . . . 51.62 -138.74 1.04 Allowed 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 116.704 -0.225 . . . . 0.0 111.248 179.401 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.51 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 0.0 OUTLIER 93.1 -24.66 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 122.749 0.419 . . . . 0.0 111.072 -179.886 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.699 ' O ' HG23 ' A' ' 42' ' ' VAL . 1.9 p -145.88 81.14 1.6 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.576 179.794 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.779 HG21 ' ND2' ' A' ' 8' ' ' ASN . 13.6 p -41.79 -47.59 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.36 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.691 -179.863 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.518 ' N ' HG13 ' A' ' 39' ' ' VAL . 1.8 mt-10 -60.56 -41.83 95.37 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 179.461 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -72.21 -42.22 51.09 Favored Glycine 0 C--O 1.223 -0.589 0 C-N-CA 120.332 -0.937 . . . . 0.0 112.229 178.968 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.951 HG21 ' CD1' ' A' ' 9' ' ' LEU . 25.3 t -45.78 -44.75 4.75 Favored 'Isoleucine or valine' 0 C--O 1.232 0.182 0 CA-C-N 116.978 0.389 . . . . 0.0 110.927 179.583 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.475 ' CD1' ' HA ' ' A' ' 40' ' ' GLU . 13.1 p-90 -79.23 -28.84 42.51 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.177 179.669 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.7 m -79.73 -36.73 36.93 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 120.487 -0.485 . . . . 0.0 110.948 179.856 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.902 HD23 ' HB2' ' A' ' 32' ' ' LEU . 1.0 OUTLIER -68.14 -32.52 72.85 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.147 -0.479 . . . . 0.0 109.79 179.375 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.512 ' HD3' ' HB2' ' A' ' 16' ' ' ALA . 8.2 ttpt -69.81 -61.53 1.74 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.273 179.263 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -57.3 -27.71 62.4 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.103 179.579 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -79.91 -53.58 6.63 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.733 179.715 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.757 HD13 ' CG ' ' A' ' 29' ' ' TYR . 6.3 tp -58.33 -24.45 24.72 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.129 0 C-N-CA 120.729 -0.388 . . . . 0.0 111.027 -179.954 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.602 HD13 ' CG ' ' A' ' 19' ' ' GLU . 1.0 OUTLIER -80.91 -34.66 33.28 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 178.812 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 8.5 m -65.75 -15.69 63.08 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.699 179.483 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.658 ' CE1' HG21 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -88.98 36.8 0.82 Allowed 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 121.604 0.716 . . . . 0.0 111.241 -179.651 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.44 ' O ' HG12 ' A' ' 54' ' ' VAL . 2.9 m -177.88 -69.96 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.705 179.242 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.44 HG12 ' O ' ' A' ' 53' ' ' THR . 0.4 OUTLIER 70.2 150.91 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.103 179.382 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 3.9 m -134.6 55.77 1.88 Allowed 'General case' 0 CA--C 1.52 -0.208 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.851 179.616 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 . . . . . 0 C--O 1.252 1.217 0 CA-C-O 118.041 -0.981 . . . . 0.0 110.986 179.924 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . 0.772 ' HA ' HD11 ' A' ' 5' ' ' LEU . 1.4 p . . . . . 0 N--CA 1.495 1.791 0 CA-C-O 120.785 0.326 . . . . 0.0 111.123 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -106.41 93.84 4.82 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.671 -179.696 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 41.54 32.63 0.24 Allowed 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.225 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 3.3 ttpt -148.61 78.41 1.41 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.573 -179.881 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.772 HD11 ' HA ' ' A' ' 1' ' ' THR . 7.6 mt -145.9 68.5 1.2 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.799 179.508 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 1.8 tt -178.29 141.64 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.176 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -167.27 137.54 2.95 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.25 0.548 . . . . 0.0 110.485 -179.984 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 168.31 -42.0 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.276 179.699 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.969 ' CD1' HG21 ' A' ' 42' ' ' VAL . 4.1 tp -57.85 -49.02 78.08 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.923 0.392 . . . . 0.0 111.296 -179.718 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.414 ' HA ' ' HD3' ' A' ' 13' ' ' LYS . 3.2 mtpt -57.46 -36.76 71.85 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.298 -179.636 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -85.12 -39.14 18.25 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.073 -179.798 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.74 -38.04 66.66 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.622 179.684 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.747 ' HB3' HG11 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -85.03 -35.66 21.76 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.756 179.608 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.459 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 3.1 mm-40 -60.05 -50.52 73.4 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 179.075 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 68.8 tt0 -64.83 -31.81 73.22 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 178.038 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.577 ' CB ' HD12 ' A' ' 33' ' ' ILE . . . -65.0 -37.78 88.78 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.175 179.194 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.802 ' O ' HG23 ' A' ' 21' ' ' VAL . 20.6 mm -58.03 -46.31 87.98 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.169 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 178.398 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.69 -32.22 73.26 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.272 -0.877 . . . . 0.0 109.47 178.237 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.519 ' CB ' HD13 ' A' ' 50' ' ' LEU . 0.4 OUTLIER -63.64 -52.42 60.87 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.565 179.268 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.803 HD22 ' HB ' ' A' ' 30' ' ' ILE . 0.3 OUTLIER -70.9 -33.98 71.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.66 179.88 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.802 HG23 ' O ' ' A' ' 17' ' ' ILE . 78.1 t -63.9 -31.17 52.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.908 0.385 . . . . 0.0 110.07 179.103 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -87.08 -37.89 17.0 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.244 179.371 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.515 ' HB3' HD11 ' A' ' 25' ' ' ILE . . . -77.57 -15.39 59.27 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.211 179.63 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 40.19 90.27 0.01 OUTLIER Glycine 0 C--N 1.335 0.482 0 CA-C-N 116.279 -0.419 . . . . 0.0 114.057 179.267 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.618 HD12 ' N ' ' A' ' 25' ' ' ILE . 0.2 OUTLIER -162.76 -167.71 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.227 0 CA-C-N 116.839 0.32 . . . . 0.0 111.138 179.06 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -33.66 95.89 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 112.398 0.518 . . . . 0.0 112.398 -179.169 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.457 ' O ' HG22 ' A' ' 30' ' ' ILE . 0.0 OUTLIER -56.21 -25.75 48.42 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.501 179.443 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.12 -46.1 11.65 Favored 'General case' 0 C--O 1.239 0.507 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.899 179.402 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.634 ' HA ' ' HG ' ' A' ' 32' ' ' LEU . 3.3 m-85 -64.37 -30.36 71.4 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.242 0.544 . . . . 0.0 110.242 179.848 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.803 ' HB ' HD22 ' A' ' 20' ' ' LEU . 0.9 OUTLIER -62.0 -26.39 39.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.415 178.175 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.7 ttmm -75.62 -37.83 59.43 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.55 179.484 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.634 ' HG ' ' HA ' ' A' ' 29' ' ' TYR . 0.1 OUTLIER -59.24 -33.74 71.38 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 120.102 -0.639 . . . . 0.0 109.783 179.43 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.63 HG22 ' HA ' ' A' ' 42' ' ' VAL . 4.9 pt -90.87 -48.33 14.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.807 179.272 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -56.2 -28.89 59.92 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.886 -179.864 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -88.62 -15.95 33.7 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.946 179.755 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.781 ' HB1' HD21 ' A' ' 9' ' ' LEU . . . 61.73 -137.7 0.51 Allowed 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.011 179.458 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.468 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 12.1 mttt 90.33 -22.86 0.1 Allowed 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 122.875 0.47 . . . . 0.0 111.23 -179.789 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.736 ' O ' HG23 ' A' ' 42' ' ' VAL . 0.7 OUTLIER -143.58 79.43 1.63 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.584 179.748 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.51 HG13 ' N ' ' A' ' 40' ' ' GLU . 13.5 p -40.15 -47.72 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.595 -179.93 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.51 ' N ' HG13 ' A' ' 39' ' ' VAL . 1.9 mt-10 -62.8 -43.95 97.45 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 179.427 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.471 ' O ' ' N ' ' A' ' 45' ' ' LEU . . . -66.49 -46.7 75.16 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.482 -0.866 . . . . 0.0 111.759 178.836 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.969 HG21 ' CD1' ' A' ' 9' ' ' LEU . 17.0 t -44.83 -41.48 2.23 Favored 'Isoleucine or valine' 0 C--O 1.234 0.248 0 CA-C-O 121.215 0.531 . . . . 0.0 110.27 179.109 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 31.7 t-105 -76.62 -31.51 57.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.957 179.098 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 m -80.53 -53.1 6.88 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.765 0.316 . . . . 0.0 110.986 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.708 ' O ' HG22 ' A' ' 49' ' ' ILE . 3.7 mm? -52.86 -35.73 57.95 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.035 0.445 . . . . 0.0 109.93 179.468 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.532 ' HG3' ' HA ' ' A' ' 16' ' ' ALA . 1.2 ttmt -68.05 -59.54 3.17 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.114 179.241 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -57.71 -31.47 66.43 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.234 179.768 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -77.16 -52.59 9.0 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.891 179.795 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.708 HG22 ' O ' ' A' ' 45' ' ' LEU . 7.1 tp -60.78 -23.88 30.57 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-O 120.792 0.329 . . . . 0.0 111.144 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.519 HD13 ' CB ' ' A' ' 19' ' ' GLU . 5.4 tp -79.33 -32.95 43.5 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 178.675 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 31.6 m -61.99 -36.63 82.06 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.2 179.519 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.782 ' CG ' ' O ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -71.63 58.25 0.3 Allowed 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 121.556 0.693 . . . . 0.0 110.635 -179.882 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 18.7 m -174.91 -70.45 0.01 OUTLIER 'General case' 0 C--O 1.232 0.132 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 179.653 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 2.6 t -76.51 105.96 5.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.474 179.149 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 60.65 -144.14 0.49 Allowed 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.156 179.816 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.241 -0.885 . . . . 0.0 110.899 -179.949 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 1.4 m . . . . . 0 N--CA 1.487 1.381 0 CA-C-O 120.7 0.286 . . . . 0.0 111.063 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.782 ' O ' HD21 ' A' ' 5' ' ' LEU . 0.0 OUTLIER -130.07 158.22 40.23 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.137 179.904 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 5.6 p90 -97.11 24.56 6.22 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.152 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.752 ' C ' HD13 ' A' ' 5' ' ' LEU . 0.0 OUTLIER -154.63 86.69 1.14 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.418 0.627 . . . . 0.0 111.041 179.687 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.782 HD21 ' O ' ' A' ' 2' ' ' THR . 0.0 OUTLIER -128.11 -38.3 1.82 Allowed 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.073 179.989 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.59 HG22 ' O ' ' A' ' 5' ' ' LEU . 0.1 OUTLIER 92.11 -31.13 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 C-N-CA 123.031 0.533 . . . . 0.0 110.876 -179.315 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.609 ' O ' HG21 ' A' ' 39' ' ' VAL . 1.1 mt 55.75 -89.5 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.37 179.279 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 73.62 32.56 1.15 Allowed 'General case' 0 C--N 1.334 -0.101 0 CA-C-O 121.454 0.645 . . . . 0.0 109.422 -178.84 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 1.069 HD23 HG21 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -73.46 -42.89 61.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.04 -0.982 . . . . 0.0 111.143 -179.266 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.896 ' N ' HD13 ' A' ' 9' ' ' LEU . 0.0 OUTLIER -51.96 -37.25 52.21 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.933 0.397 . . . . 0.0 111.234 -179.478 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.08 -30.31 19.99 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.142 -179.794 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.19 -37.1 85.9 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.261 179.579 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.494 ' HG2' ' N ' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -85.22 -37.69 19.81 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.948 179.701 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.494 ' N ' ' HG2' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -56.46 -45.77 80.68 Favored 'General case' 0 C--O 1.233 0.234 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 179.068 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -68.27 -33.53 74.53 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.382 -0.826 . . . . 0.0 108.876 177.859 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.6 ' HB1' ' CD1' ' A' ' 33' ' ' ILE . . . -66.36 -37.41 85.24 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.317 179.54 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.773 ' O ' HG23 ' A' ' 21' ' ' VAL . 32.0 mm -58.81 -48.47 86.06 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.171 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 178.751 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.66 -32.86 73.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.691 178.5 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.602 ' CG ' HD13 ' A' ' 50' ' ' LEU . 0.3 OUTLIER -61.51 -52.41 64.61 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.549 -0.75 . . . . 0.0 111.06 179.861 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.575 HD22 ' HB ' ' A' ' 30' ' ' ILE . 0.2 OUTLIER -76.26 -34.91 59.15 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.951 -179.659 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.773 HG23 ' O ' ' A' ' 17' ' ' ILE . 71.3 t -63.42 -31.12 51.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 120.941 0.4 . . . . 0.0 110.374 179.528 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -91.49 -34.38 14.82 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.427 179.6 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -79.96 -15.17 57.82 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.323 179.791 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.791 ' O ' HG23 ' A' ' 25' ' ' ILE . . . 46.42 102.49 0.01 OUTLIER Glycine 0 CA--C 1.523 0.59 0 C-N-CA 121.315 -0.469 . . . . 0.0 113.334 179.476 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.802 HD12 ' CE1' ' A' ' 52' ' ' PHE . 1.1 pt -172.99 -173.4 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.21 0 CA-C-N 117.003 0.401 . . . . 0.0 111.326 179.501 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -36.84 95.14 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 -179.242 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.612 ' O ' HG22 ' A' ' 30' ' ' ILE . 1.6 pt-20 -54.14 -25.48 22.55 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.732 179.47 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -44.52 -47.49 10.14 Favored 'General case' 0 C--O 1.239 0.522 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.593 179.303 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.632 ' HA ' ' HG ' ' A' ' 32' ' ' LEU . 2.1 m-85 -63.81 -30.46 71.55 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.237 0.541 . . . . 0.0 110.06 179.655 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.612 HG22 ' O ' ' A' ' 27' ' ' GLU . 1.4 tt -60.81 -26.42 38.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.397 177.953 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.1 tptm -76.07 -37.55 58.11 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.593 179.515 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.725 ' HB2' HD13 ' A' ' 45' ' ' LEU . 0.1 OUTLIER -60.48 -32.42 71.41 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 119.885 -0.726 . . . . 0.0 109.856 179.349 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.6 ' CD1' ' HB1' ' A' ' 16' ' ' ALA . 4.6 pt -91.86 -48.34 13.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.851 179.456 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.652 ' HB2' HD11 ' A' ' 17' ' ' ILE . . . -58.54 -29.35 66.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.907 -179.687 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 7.8 t-20 -85.19 -17.96 35.55 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.936 179.768 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.533 ' CB ' HD21 ' A' ' 9' ' ' LEU . . . 61.28 -143.32 0.47 Allowed 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 116.626 -0.261 . . . . 0.0 110.923 179.612 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.497 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 0.0 OUTLIER 90.18 -21.79 0.12 Allowed 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 122.633 0.373 . . . . 0.0 111.406 -179.973 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.869 ' O ' HG23 ' A' ' 42' ' ' VAL . 0.6 OUTLIER -141.39 77.02 1.57 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.683 0.277 . . . . 0.0 110.639 179.878 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.609 HG21 ' O ' ' A' ' 7' ' ' LEU . 12.3 p -39.38 -47.04 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.63 -179.851 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.507 ' N ' HG13 ' A' ' 39' ' ' VAL . 0.4 OUTLIER -61.16 -52.69 63.76 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 179.563 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.454 ' O ' ' HG ' ' A' ' 45' ' ' LEU . . . -63.35 -37.55 95.02 Favored Glycine 0 C--O 1.226 -0.372 0 C-N-CA 120.246 -0.978 . . . . 0.0 112.186 179.234 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 1.069 HG21 HD23 ' A' ' 9' ' ' LEU . 29.1 t -49.9 -44.53 21.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 121.067 0.46 . . . . 0.0 110.387 179.416 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.499 ' CZ2' ' HA ' ' A' ' 40' ' ' GLU . 1.1 p90 -81.49 -24.54 36.66 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.283 179.234 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.8 m -79.98 -48.04 14.0 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-O 120.874 0.369 . . . . 0.0 110.616 179.885 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.725 HD13 ' HB2' ' A' ' 32' ' ' LEU . 2.1 mt -62.02 -32.36 72.84 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.863 179.26 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.439 ' HG3' ' HA ' ' A' ' 16' ' ' ALA . 4.0 tttm -67.67 -60.02 2.87 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.468 179.421 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -60.58 -30.23 69.68 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.301 179.748 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 -77.22 -52.29 9.48 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.974 179.802 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.694 HG22 ' O ' ' A' ' 45' ' ' LEU . 7.2 tp -60.25 -24.03 29.47 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.07 -179.943 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.602 HD13 ' CG ' ' A' ' 19' ' ' GLU . 3.3 tp -79.38 -32.84 43.16 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 178.469 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.859 HG23 HG23 ' A' ' 55' ' ' THR . 50.9 m -59.66 -37.46 78.81 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.915 179.205 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.802 ' CE1' HD12 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -74.09 56.86 0.62 Allowed 'General case' 0 CA--C 1.539 0.549 0 CA-C-O 121.58 0.705 . . . . 0.0 110.536 179.813 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.4 m 173.83 -67.26 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.147 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 179.827 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 3.0 t -83.24 -67.61 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.438 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.952 179.419 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.859 HG23 HG23 ' A' ' 51' ' ' THR . 0.2 OUTLIER 69.69 114.92 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.048 179.968 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.221 -0.895 . . . . 0.0 110.906 179.863 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 11.9 t . . . . . 0 N--CA 1.484 1.251 0 CA-C-O 120.809 0.337 . . . . 0.0 111.201 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -139.38 -67.04 0.45 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.668 -179.78 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 4.6 t80 58.66 25.39 13.24 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.142 0.496 . . . . 0.0 111.187 -179.696 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 13.0 ttpt -167.68 -65.53 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.001 179.925 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.2 mt 62.31 -85.12 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.119 179.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 34.7 mm 47.82 92.68 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.335 0 CA-C-O 120.564 0.221 . . . . 0.0 110.959 179.606 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -121.7 -169.29 1.84 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.035 0.445 . . . . 0.0 111.264 -179.834 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 175.75 -46.02 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.783 179.787 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.727 HD21 ' HB2' ' A' ' 36' ' ' ALA . 9.2 tt -67.12 -48.86 66.84 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 121.017 0.436 . . . . 0.0 110.721 179.649 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.465 ' HA ' ' HD3' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -52.21 -34.0 43.62 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.738 -0.664 . . . . 0.0 110.825 179.842 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.401 ' O ' ' HG3' ' A' ' 14' ' ' GLU . 0.8 OUTLIER -89.3 -29.67 19.0 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.775 179.802 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.4 -38.07 88.22 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.057 179.239 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.631 ' HB3' HG11 ' A' ' 42' ' ' VAL . 0.0 OUTLIER -85.41 -35.45 21.3 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.037 179.704 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.544 ' O ' HG22 ' A' ' 17' ' ' ILE . 0.3 OUTLIER -59.9 -42.33 93.61 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 179.128 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -72.18 -30.93 65.45 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 177.833 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.649 ' CB ' HD12 ' A' ' 33' ' ' ILE . . . -68.67 -47.2 67.12 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.071 -0.968 . . . . 0.0 111.149 179.661 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.709 ' O ' HG23 ' A' ' 21' ' ' VAL . 0.5 OUTLIER -57.2 -39.24 65.95 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.235 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 179.145 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.09 -32.47 72.81 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 177.384 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.562 ' CG ' HD13 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -66.11 -49.59 66.99 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.478 179.152 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.796 HD22 ' HB ' ' A' ' 30' ' ' ILE . 0.2 OUTLIER -74.47 -35.75 63.28 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.948 -179.758 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.709 HG23 ' O ' ' A' ' 17' ' ' ILE . 44.0 t -63.4 -31.22 52.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 120.847 0.356 . . . . 0.0 110.21 179.461 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -89.51 -34.91 16.23 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.334 179.589 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.411 ' HB3' HD11 ' A' ' 25' ' ' ILE . . . -79.7 -14.97 58.37 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.355 179.779 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.654 ' O ' HG23 ' A' ' 25' ' ' ILE . . . 46.33 97.39 0.01 OUTLIER Glycine 0 CA--C 1.522 0.506 0 C-N-CA 121.051 -0.595 . . . . 0.0 113.287 179.603 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.721 ' N ' HD13 ' A' ' 25' ' ' ILE . 0.1 OUTLIER -162.09 -176.62 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.461 0.122 0 CA-C-N 116.884 0.342 . . . . 0.0 111.479 179.986 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -45.69 96.38 0.01 OUTLIER 'General case' 0 CA--C 1.518 -0.267 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.596 -179.452 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.539 ' O ' HG22 ' A' ' 30' ' ' ILE . 19.5 mm-40 -45.62 -25.11 0.42 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.194 178.681 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.402 ' CD ' HD21 ' A' ' 32' ' ' LEU . 0.1 OUTLIER -39.53 -50.59 2.19 Favored 'General case' 0 C--O 1.239 0.519 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.917 178.754 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.665 ' CG ' HD13 ' A' ' 49' ' ' ILE . 2.8 m-85 -65.47 -32.83 74.65 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.972 179.665 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.796 ' HB ' HD22 ' A' ' 20' ' ' LEU . 1.0 OUTLIER -59.76 -26.28 34.73 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.391 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.556 178.091 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.7 tttm -75.94 -37.81 58.28 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.455 179.494 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.636 ' HG ' ' HA ' ' A' ' 29' ' ' TYR . 0.1 OUTLIER -59.57 -33.03 70.92 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 120.18 -0.608 . . . . 0.0 109.766 179.308 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.744 HG22 ' HA ' ' A' ' 42' ' ' VAL . 3.8 pt -91.8 -45.9 14.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.967 179.573 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -58.48 -28.8 65.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.678 -179.866 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -88.62 -12.53 42.31 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.123 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.727 ' HB2' HD21 ' A' ' 9' ' ' LEU . . . 61.45 -140.02 0.5 Allowed 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 116.734 -0.212 . . . . 0.0 110.996 179.391 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.547 ' CB ' ' O ' ' A' ' 36' ' ' ALA . 0.0 OUTLIER 96.33 -27.41 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 122.783 0.433 . . . . 0.0 110.758 -179.786 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.701 ' O ' HG23 ' A' ' 42' ' ' VAL . 0.6 OUTLIER -144.03 83.37 1.74 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.598 179.73 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.699 ' CA ' HD12 ' A' ' 9' ' ' LEU . 8.8 p -40.77 -48.18 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.464 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.475 -179.879 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.518 ' N ' HG13 ' A' ' 39' ' ' VAL . 0.0 OUTLIER -61.86 -43.0 99.73 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.846 -0.427 . . . . 0.0 109.846 179.304 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.475 ' O ' ' N ' ' A' ' 45' ' ' LEU . . . -66.58 -46.51 75.99 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.522 -0.847 . . . . 0.0 111.762 178.879 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.744 ' HA ' HG22 ' A' ' 33' ' ' ILE . 10.6 t -45.29 -41.97 2.93 Favored 'Isoleucine or valine' 0 C--O 1.233 0.201 0 CA-C-O 121.287 0.565 . . . . 0.0 110.196 179.168 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 14.3 t90 -76.76 -30.28 56.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.987 179.255 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.5 m -82.43 -54.62 5.06 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.831 0.348 . . . . 0.0 111.161 -179.782 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.688 ' O ' HG22 ' A' ' 49' ' ' ILE . 3.9 mm? -52.93 -32.49 45.94 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 179.306 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.5 ' HG3' ' HA ' ' A' ' 16' ' ' ALA . 0.3 OUTLIER -70.02 -60.77 2.09 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.271 -0.877 . . . . 0.0 110.245 179.296 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -58.25 -31.91 67.86 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.196 179.656 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -75.49 -54.98 6.14 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.836 179.763 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.688 HG22 ' O ' ' A' ' 45' ' ' LEU . 7.7 tp -56.84 -23.88 18.71 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.188 0 C-N-CA 120.705 -0.398 . . . . 0.0 111.236 -179.85 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.566 ' O ' HG23 ' A' ' 54' ' ' VAL . 4.2 tp -79.04 -34.91 43.42 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 178.931 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.45 ' HA ' HG23 ' A' ' 54' ' ' VAL . 17.4 m -66.06 -18.05 65.09 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.755 179.719 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.551 ' CG ' ' O ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -88.85 34.32 0.78 Allowed 'General case' 0 CA--C 1.532 0.257 0 CA-C-O 121.467 0.651 . . . . 0.0 111.215 -179.732 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.8 m 177.59 -67.69 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.145 -0.934 . . . . 0.0 109.202 179.488 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.566 HG23 ' O ' ' A' ' 50' ' ' LEU . 67.6 t 55.09 93.26 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.452 -0.374 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.168 179.202 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 75.4 m -122.56 75.07 1.23 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.831 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.25 1.093 0 CA-C-O 118.166 -0.921 . . . . 0.0 110.856 179.955 . . . . . . . . 1 1 . 1 stop_ save_