data_2kq4_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 2kq4 _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 ' X' X ' 2' ' ' GLN . . . . . . . . . . . . . 29.7 mt-30 . . . . . 0 N--CA 1.466 0.368 0 CA-C-O 121.162 0.506 . . . . 0.0 111.072 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' X' X ' 3' ' ' TYR . . . . . . . . . . . . . 72.8 m-85 -115.66 143.1 45.84 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.447 179.341 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 4' ' ' LYS . . . . . . . . . . . . . 45.7 tttp -119.6 127.14 52.67 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 120.964 0.412 . . . . 0.0 110.331 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 5' ' ' LEU . . . . . 0.437 ' CD1' ' C ' ' X' ' 5' ' ' LEU . 1.0 OUTLIER -107.59 127.11 53.35 Favored 'General case' 0 N--CA 1.465 0.276 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 179.471 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' X' X ' 6' ' ' ILE . . . . . 0.41 ' N ' HD23 ' X' ' 5' ' ' LEU . 27.2 mm -98.43 132.91 42.59 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.493 0 CA-C-O 121.231 0.539 . . . . 0.0 109.78 -179.365 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' X' X ' 7' ' ' LEU . . . . . . . . . . . . . 6.0 mp -91.83 107.72 19.41 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.848 -178.617 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 8' ' ' ASN . . . . . 0.492 ' ND2' ' O ' ' X' ' 54' ' ' VAL . 1.7 p-10 -125.76 85.85 2.45 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 107.045 -1.465 . . . . 0.0 107.045 176.914 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' X' X ' 9' ' ' GLY . . . . . 0.704 ' N ' ' HZ1' ' X' ' 13' ' ' LYS . . . -116.06 -162.67 13.26 Favored Glycine 0 C--N 1.334 0.439 0 N-CA-C 111.271 -0.732 . . . . 0.0 111.271 -178.785 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' X' X ' 10' ' ' LYS . . . . . . . . . . . . . 48.1 mttt -66.67 -54.5 22.47 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 120.523 -0.471 . . . . 0.0 110.753 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 11' ' ' THR . . . . . . . . . . . . . 42.6 p -130.88 -8.78 3.94 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 120.692 0.282 . . . . 0.0 111.208 179.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 12' ' ' LEU . . . . . 0.495 ' C ' ' HZ3' ' X' ' 13' ' ' LYS . 0.6 OUTLIER -95.93 114.69 26.44 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.107 -178.713 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' X' X ' 13' ' ' LYS . . . . . 0.704 ' HZ1' ' N ' ' X' ' 9' ' ' GLY . 0.3 OUTLIER -135.54 142.56 45.4 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-O 120.942 0.401 . . . . 0.0 110.723 179.66 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' X' X ' 14' ' ' GLY . . . . . 0.432 ' O ' ' OE1' ' X' ' 15' ' ' GLU . . . 174.27 -158.03 26.22 Favored Glycine 0 CA--C 1.533 1.205 0 N-CA-C 110.937 -0.865 . . . . 0.0 110.937 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' X' X ' 15' ' ' GLU . . . . . 0.432 ' OE1' ' O ' ' X' ' 14' ' ' GLY . 5.0 mm-40 -134.17 150.88 51.12 Favored 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 110.139 -0.319 . . . . 0.0 110.139 179.689 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 2.3 m -148.02 129.43 14.83 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.278 178.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 17' ' ' THR . . . . . . . . . . . . . 2.4 m -131.44 157.36 43.67 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 120.878 0.37 . . . . 0.0 110.546 179.835 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 18' ' ' THR . . . . . . . . . . . . . 7.5 t -149.52 152.96 36.44 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.019 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 19' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -103.93 105.81 16.12 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 179.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' X' X ' 20' ' ' ALA . . . . . . . . . . . . . . . -131.56 161.61 32.24 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 121.16 0.505 . . . . 0.0 111.235 -179.189 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 21' ' ' VAL . . . . . . . . . . . . . 1.2 p -87.02 -37.4 11.14 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.222 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.48 179.314 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 22' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -111.33 156.0 22.22 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.927 -179.416 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.99 -46.16 37.12 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.03 179.806 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 24' ' ' ALA . . . . . . . . . . . . . . . -62.41 -39.75 94.28 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.473 -179.011 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 25' ' ' THR . . . . . . . . . . . . . 1.1 t -64.14 -31.95 73.33 Favored 'General case' 0 C--N 1.345 0.393 0 C-N-CA 120.73 -0.388 . . . . 0.0 110.622 -179.609 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.03 -35.87 78.98 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.901 0.381 . . . . 0.0 110.651 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 27' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -61.76 -28.38 69.4 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.567 -179.775 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 28' ' ' LYS . . . . . . . . . . . . . 83.4 mttt -56.93 -43.1 81.12 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.178 -178.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 29' ' ' VAL . . . . . 0.427 ' O ' ' CB ' ' X' ' 33' ' ' TYR . 13.8 t -69.99 -51.19 42.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.533 179.298 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' X' X ' 30' ' ' PHE . . . . . . . . . . . . . 61.0 m-85 -61.91 -43.18 99.38 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.873 -179.301 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 31' ' ' LYS . . . . . . . . . . . . . 2.7 tppt? -66.34 -47.74 72.5 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 120.534 -0.466 . . . . 0.0 110.52 -179.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 32' ' ' GLN . . . . . . . . . . . . . 57.8 tp60 -71.81 -33.72 68.76 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.657 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 33' ' ' TYR . . . . . 0.427 ' CB ' ' O ' ' X' ' 29' ' ' VAL . 19.1 t80 -61.38 -30.52 70.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.478 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' X' X ' 34' ' ' ALA . . . . . 0.44 ' O ' ' OD1' ' X' ' 37' ' ' ASN . . . -59.32 -39.29 82.61 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.638 -178.6 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' X' X ' 35' ' ' ASN . . . . . . . . . . . . . 39.3 t-20 -69.06 -34.84 75.81 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 120.505 -0.478 . . . . 0.0 109.759 179.446 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 36' ' ' ASP . . . . . 0.508 ' OD1' ' N ' ' X' ' 36' ' ' ASP . 0.7 OUTLIER -67.28 -35.3 79.21 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 115.709 -0.678 . . . . 0.0 112.104 -179.538 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' X' X ' 37' ' ' ASN . . . . . 0.519 ' OD1' ' N ' ' X' ' 38' ' ' GLY . 24.6 p-10 -95.37 -25.17 16.39 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 120.86 -0.336 . . . . 0.0 111.512 -178.877 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' X' X ' 38' ' ' GLY . . . . . 0.519 ' N ' ' OD1' ' X' ' 37' ' ' ASN . . . 103.17 28.57 6.07 Favored Glycine 0 CA--C 1.534 1.238 0 CA-C-O 119.473 -0.626 . . . . 0.0 114.172 177.165 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' X' X ' 39' ' ' VAL . . . . . 0.472 ' CG2' ' O ' ' X' ' 39' ' ' VAL . 2.4 m -122.77 113.33 37.75 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 CA-C-N 118.201 1.001 . . . . 0.0 110.569 178.749 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' X' X ' 40' ' ' ASP . . . . . . . . . . . . . 19.0 t0 -127.35 108.01 10.48 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 179.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -145.19 -165.68 11.34 Favored Glycine 0 CA--C 1.531 1.065 0 N-CA-C 111.485 -0.646 . . . . 0.0 111.485 179.8 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 42' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -75.61 125.14 28.45 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 121.023 0.439 . . . . 0.0 110.429 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 43' ' ' TRP . . . . . . . . . . . . . 79.2 m95 -91.79 161.45 14.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.543 0.687 . . . . 0.0 111.59 -179.46 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 44' ' ' THR . . . . . 0.472 ' CG2' ' OG1' ' X' ' 53' ' ' THR . 9.1 t -156.91 167.57 30.08 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 114.617 -1.174 . . . . 0.0 108.497 179.162 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' X' X ' 45' ' ' TYR . . . . . 0.636 ' CD1' ' CE1' ' X' ' 52' ' ' PHE . 14.7 t80 -171.08 133.61 0.89 Allowed 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 119.458 -0.897 . . . . 0.0 112.062 -179.787 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' X' X ' 46' ' ' ASP . . . . . . . . . . . . . 12.7 t0 -123.95 112.39 17.15 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 177.627 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 47' ' ' ASP . . . . . 0.408 ' OD1' ' O ' ' X' ' 47' ' ' ASP . 10.1 t70 -67.19 -16.74 64.49 Favored 'General case' 0 C--O 1.231 0.106 0 CA-C-O 120.656 0.265 . . . . 0.0 110.997 -179.413 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' X' X ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.31 -12.97 59.93 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.138 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 49' ' ' THR . . . . . . . . . . . . . 2.6 p -128.16 2.93 5.81 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 110.526 -0.175 . . . . 0.0 110.526 -179.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 50' ' ' LYS . . . . . . . . . . . . . 68.5 mmtt 41.57 58.62 2.68 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 120.827 -0.349 . . . . 0.0 110.571 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 51' ' ' THR . . . . . . . . . . . . . 91.1 m -148.47 127.55 12.82 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 112.302 0.482 . . . . 0.0 112.302 -179.282 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 52' ' ' PHE . . . . . 0.636 ' CE1' ' CD1' ' X' ' 45' ' ' TYR . 19.4 m-85 -107.9 155.38 20.35 Favored 'General case' 0 C--N 1.344 0.357 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 178.318 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' X' X ' 53' ' ' THR . . . . . 0.472 ' OG1' ' CG2' ' X' ' 44' ' ' THR . 68.6 p -152.48 130.04 11.48 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 120.454 -0.498 . . . . 0.0 110.682 179.464 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' X' X ' 54' ' ' VAL . . . . . 0.492 ' O ' ' ND2' ' X' ' 8' ' ' ASN . 11.5 p -113.81 123.74 69.77 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 178.72 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' X' X ' 55' ' ' THR . . . . . . . . . . . . . 5.0 t -121.74 125.02 45.6 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.319 -178.412 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 56' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 . . . . . 0 C--O 1.22 -0.484 0 CA-C-O 117.955 -1.022 . . . . 0.0 110.348 179.765 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' X' X ' 2' ' ' GLN . . . . . . . . . . . . . 86.5 mt-30 . . . . . 0 N--CA 1.465 0.294 0 CA-C-O 121.006 0.431 . . . . 0.0 110.936 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' X' X ' 3' ' ' TYR . . . . . . . . . . . . . 60.6 m-85 -124.67 137.84 54.34 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.555 179.283 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 4' ' ' LYS . . . . . . . . . . . . . 10.0 ttmm -119.62 127.35 52.85 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 120.935 0.398 . . . . 0.0 110.303 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 5' ' ' LEU . . . . . 0.44 ' CD1' ' C ' ' X' ' 5' ' ' LEU . 1.0 OUTLIER -108.95 128.17 54.7 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 179.458 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' X' X ' 6' ' ' ILE . . . . . 0.424 ' N ' HD22 ' X' ' 5' ' ' LEU . 28.1 mm -98.45 132.12 44.2 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.485 0 CA-C-O 120.958 0.409 . . . . 0.0 109.954 -179.385 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 7' ' ' LEU . . . . . . . . . . . . . 6.2 mp -92.16 112.54 24.51 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.246 -179.221 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 8' ' ' ASN . . . . . 0.498 ' ND2' ' O ' ' X' ' 54' ' ' VAL . 2.9 p-10 -132.58 87.51 2.42 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.199 -1.038 . . . . 0.0 108.199 178.214 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 9' ' ' GLY . . . . . 0.52 ' C ' ' HZ2' ' X' ' 13' ' ' LYS . . . -122.85 -158.01 10.09 Favored Glycine 0 C--N 1.335 0.523 0 N-CA-C 111.201 -0.759 . . . . 0.0 111.201 -178.905 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 10' ' ' LYS . . . . . . . . . . . . . 70.2 mttt -73.64 -47.42 40.19 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.785 -0.366 . . . . 0.0 111.239 -179.534 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 11' ' ' THR . . . . . . . . . . . . . 41.6 p -130.62 -15.8 3.47 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 -179.384 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 12' ' ' LEU . . . . . 0.482 ' N ' ' HZ3' ' X' ' 13' ' ' LYS . 0.4 OUTLIER -99.36 112.96 25.04 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 120.762 0.315 . . . . 0.0 111.449 -178.672 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' X' X ' 13' ' ' LYS . . . . . 0.52 ' HZ2' ' C ' ' X' ' 9' ' ' GLY . 0.3 OUTLIER -135.01 139.2 44.66 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.103 179.265 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' X' X ' 14' ' ' GLY . . . . . . . . . . . . . . . 174.38 -154.75 19.82 Favored Glycine 0 CA--C 1.535 1.305 0 N-CA-C 110.861 -0.896 . . . . 0.0 110.861 -179.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 15' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -133.39 150.29 51.8 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 120.731 0.3 . . . . 0.0 110.446 179.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 2.8 m -148.06 129.42 14.78 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.328 178.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 17' ' ' THR . . . . . . . . . . . . . 2.4 m -130.28 156.86 43.95 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 120.961 0.41 . . . . 0.0 110.728 179.794 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 18' ' ' THR . . . . . . . . . . . . . 7.5 t -148.97 153.3 37.74 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.86 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 19' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -103.93 105.63 15.88 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.217 -0.447 . . . . 0.0 109.88 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 20' ' ' ALA . . . . . . . . . . . . . . . -136.71 163.46 30.55 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.741 -179.639 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 21' ' ' VAL . . . . . . . . . . . . . 1.1 p -89.81 -40.7 13.2 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.279 0 CA-C-N 115.883 -0.599 . . . . 0.0 109.389 179.291 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 22' ' ' ASP . . . . . . . . . . . . . 37.1 m-20 -103.69 155.11 18.83 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.413 -179.157 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 23' ' ' ALA . . . . . . . . . . . . . . . -75.16 -45.97 37.29 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.925 179.657 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.81 -39.87 95.26 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.454 -179.049 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 25' ' ' THR . . . . . . . . . . . . . 1.2 t -63.55 -34.06 76.96 Favored 'General case' 0 C--N 1.346 0.423 0 C-N-CA 120.617 -0.433 . . . . 0.0 110.607 -179.53 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.25 -35.86 78.57 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.945 0.403 . . . . 0.0 110.568 179.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 27' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -60.02 -29.32 68.42 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.812 -179.493 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 28' ' ' LYS . . . . . . . . . . . . . 41.2 mtmt -56.03 -41.97 75.8 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 120.416 -0.513 . . . . 0.0 110.416 -178.7 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 29' ' ' VAL . . . . . 0.428 ' O ' ' CB ' ' X' ' 33' ' ' TYR . 11.5 t -70.26 -51.71 36.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-O 120.984 0.421 . . . . 0.0 110.526 179.337 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 30' ' ' PHE . . . . . . . . . . . . . 57.6 m-85 -61.96 -42.9 99.64 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.986 -179.188 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 31' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -61.66 -51.25 69.22 Favored 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 120.494 -0.482 . . . . 0.0 110.73 -179.47 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 32' ' ' GLN . . . . . . . . . . . . . 45.0 tt0 -73.48 -35.93 65.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.285 -179.606 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 33' ' ' TYR . . . . . 0.428 ' CB ' ' O ' ' X' ' 29' ' ' VAL . 70.0 t80 -61.8 -46.1 91.0 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.552 -0.294 . . . . 0.0 111.09 -179.388 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.16 -41.37 88.21 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.609 -0.437 . . . . 0.0 110.049 -179.287 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 35' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -60.46 -43.5 96.84 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 178.701 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 36' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -66.99 -26.48 66.82 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.342 179.048 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 37' ' ' ASN . . . . . 0.415 ' ND2' ' CE2' ' X' ' 33' ' ' TYR . 1.5 t-20 -83.77 -25.89 30.1 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.867 -178.96 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 38' ' ' GLY . . . . . . . . . . . . . . . 114.8 -37.52 3.49 Favored Glycine 0 CA--C 1.531 1.038 0 C-N-CA 121.559 -0.353 . . . . 0.0 112.285 178.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 39' ' ' VAL . . . . . . . . . . . . . 1.4 p -80.55 108.75 14.26 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.305 0 CA-C-N 117.333 0.567 . . . . 0.0 111.107 -179.123 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 40' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -127.28 110.89 13.3 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 115.846 -0.616 . . . . 0.0 109.816 179.325 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 41' ' ' GLY . . . . . 0.419 ' H ' ' CG2' ' X' ' 54' ' ' VAL . . . -141.37 -157.36 7.14 Favored Glycine 0 CA--C 1.533 1.174 0 C-N-CA 120.764 -0.731 . . . . 0.0 111.927 -179.485 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 42' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -75.12 133.05 41.61 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 120.877 0.37 . . . . 0.0 110.254 -179.777 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 43' ' ' TRP . . . . . . . . . . . . . 82.0 m95 -98.02 161.5 13.69 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.734 0.778 . . . . 0.0 112.078 -178.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 44' ' ' THR . . . . . 0.499 ' CG2' ' OG1' ' X' ' 53' ' ' THR . 2.5 t -157.07 169.1 25.58 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 114.348 -1.297 . . . . 0.0 108.818 179.381 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 45' ' ' TYR . . . . . 0.627 ' CD1' ' CE1' ' X' ' 52' ' ' PHE . 7.0 t80 -173.38 135.14 0.54 Allowed 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 119.801 -0.76 . . . . 0.0 111.7 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 46' ' ' ASP . . . . . 0.401 ' N ' ' CD1' ' X' ' 45' ' ' TYR . 8.5 t0 -123.56 112.42 17.43 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 115.269 -0.878 . . . . 0.0 108.648 177.955 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 47' ' ' ASP . . . . . 0.447 ' CG ' ' HZ1' ' X' ' 50' ' ' LYS . 11.7 t70 -66.51 -14.65 62.57 Favored 'General case' 0 C--N 1.334 -0.101 0 CA-C-O 120.825 0.345 . . . . 0.0 110.714 -179.547 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.82 -13.19 59.59 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.149 -179.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 49' ' ' THR . . . . . . . . . . . . . 3.0 p -129.03 4.29 5.31 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 112.138 0.421 . . . . 0.0 112.138 -178.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 50' ' ' LYS . . . . . 0.447 ' HZ1' ' CG ' ' X' ' 47' ' ' ASP . 11.3 mmpt? 44.9 56.0 5.65 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 119.76 -0.776 . . . . 0.0 110.654 -179.694 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 51' ' ' THR . . . . . . . . . . . . . 36.6 m -149.91 130.0 13.55 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 112.519 0.563 . . . . 0.0 112.519 -179.015 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 52' ' ' PHE . . . . . 0.627 ' CE1' ' CD1' ' X' ' 45' ' ' TYR . 14.0 m-85 -110.89 154.3 24.25 Favored 'General case' 0 C--N 1.346 0.442 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 178.236 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 53' ' ' THR . . . . . 0.499 ' OG1' ' CG2' ' X' ' 44' ' ' THR . 47.5 p -150.95 131.14 13.54 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 120.333 -0.547 . . . . 0.0 110.472 179.151 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 54' ' ' VAL . . . . . 0.498 ' O ' ' ND2' ' X' ' 8' ' ' ASN . 10.8 p -113.48 124.31 69.99 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 179.176 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 55' ' ' THR . . . . . 0.453 ' O ' ' CG2' ' X' ' 55' ' ' THR . 4.7 t -124.82 120.99 33.28 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 116.4 -0.363 . . . . 0.0 111.445 -178.594 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 56' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 . . . . . 0 C--O 1.22 -0.459 0 CA-C-O 117.917 -1.04 . . . . 0.0 110.208 179.389 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' X' X ' 2' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 . . . . . 0 N--CA 1.464 0.241 0 CA-C-O 120.998 0.427 . . . . 0.0 111.177 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' X' X ' 3' ' ' TYR . . . . . . . . . . . . . 64.5 m-85 -115.99 141.22 48.41 Favored 'General case' 0 CA--C 1.517 -0.308 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 178.733 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' X' X ' 4' ' ' LYS . . . . . . . . . . . . . 49.8 tttp -119.47 127.28 52.92 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 120.767 0.317 . . . . 0.0 110.34 -179.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' X' X ' 5' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -103.32 130.01 50.49 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.109 179.809 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 6' ' ' ILE . . . . . . . . . . . . . 32.6 mm -101.17 127.3 54.55 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.485 0 N-CA-C 109.349 -0.612 . . . . 0.0 109.349 178.07 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' X' X ' 7' ' ' LEU . . . . . . . . . . . . . 6.3 mp -93.45 112.11 23.93 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.502 -178.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' X' X ' 8' ' ' ASN . . . . . 0.558 ' N ' ' OD1' ' X' ' 8' ' ' ASN . 1.9 p-10 -134.59 87.61 2.37 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 178.237 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 9' ' ' GLY . . . . . 0.512 ' H ' ' NZ ' ' X' ' 13' ' ' LYS . . . -125.76 -157.4 9.6 Favored Glycine 0 C--N 1.336 0.543 0 N-CA-C 111.404 -0.678 . . . . 0.0 111.404 -178.971 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 10' ' ' LYS . . . . . . . . . . . . . 70.8 mttt -79.97 -49.18 12.21 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 121.059 -0.256 . . . . 0.0 111.543 -179.248 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' X' X ' 11' ' ' THR . . . . . . . . . . . . . 42.5 p -130.2 18.46 5.44 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -179.031 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' X' X ' 12' ' ' LEU . . . . . 0.74 ' H ' ' HZ3' ' X' ' 13' ' ' LYS . 0.4 OUTLIER -138.41 106.34 5.68 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 120.803 0.335 . . . . 0.0 110.905 -179.699 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' X' X ' 13' ' ' LYS . . . . . 0.74 ' HZ3' ' H ' ' X' ' 12' ' ' LEU . 0.2 OUTLIER -130.78 138.94 50.16 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.273 179.509 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' X' X ' 14' ' ' GLY . . . . . 0.427 ' O ' ' OE2' ' X' ' 15' ' ' GLU . . . 173.87 -155.4 21.79 Favored Glycine 0 CA--C 1.533 1.183 0 N-CA-C 111.158 -0.777 . . . . 0.0 111.158 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 15' ' ' GLU . . . . . 0.427 ' OE2' ' O ' ' X' ' 14' ' ' GLY . 6.6 mm-40 -134.11 151.98 51.63 Favored 'General case' 0 N--CA 1.465 0.291 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 179.609 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -147.75 141.67 25.85 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 179.142 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 17' ' ' THR . . . . . . . . . . . . . 2.6 m -144.4 154.55 43.1 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 121.19 0.519 . . . . 0.0 110.978 179.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' X' X ' 18' ' ' THR . . . . . 0.412 ' CG2' ' CZ ' ' X' ' 30' ' ' PHE . 14.6 t -155.45 153.58 30.55 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.411 -179.845 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 19' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -103.65 105.61 15.89 Favored 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 179.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' X' X ' 20' ' ' ALA . . . . . . . . . . . . . . . -126.98 160.45 31.03 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.798 -179.678 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' X' X ' 21' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -80.77 -41.4 19.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 N-CA-C 109.29 -0.634 . . . . 0.0 109.29 179.277 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 22' ' ' ASP . . . . . 0.445 ' N ' ' OD1' ' X' ' 22' ' ' ASP . 32.1 p-10 -127.99 161.47 29.08 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.573 -179.774 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.2 -35.19 63.93 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.028 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' X' X ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.63 -37.65 76.37 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.91 -178.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' X' X ' 25' ' ' THR . . . . . 0.402 ' CG2' ' OD1' ' X' ' 22' ' ' ASP . 1.5 t -75.23 -40.19 59.25 Favored 'General case' 0 C--N 1.345 0.376 0 CA-C-N 118.129 0.422 . . . . 0.0 111.239 -179.337 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.93 -35.58 78.67 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.849 0.356 . . . . 0.0 111.162 -179.448 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' X' X ' 27' ' ' GLU . . . . . 0.435 ' O ' ' CB ' ' X' ' 31' ' ' LYS . 1.6 pt-20 -59.59 -30.46 68.69 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.237 -179.235 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 28' ' ' LYS . . . . . . . . . . . . . 81.7 mttt -58.07 -48.83 78.93 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.307 -0.557 . . . . 0.0 110.326 -178.425 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' X' X ' 29' ' ' VAL . . . . . 0.43 ' O ' ' CB ' ' X' ' 33' ' ' TYR . 12.4 t -72.55 -51.72 27.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-O 121.189 0.518 . . . . 0.0 110.795 179.24 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 30' ' ' PHE . . . . . 0.412 ' CZ ' ' CG2' ' X' ' 18' ' ' THR . 4.6 m-30 -61.48 -43.18 99.33 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.828 -178.672 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 31' ' ' LYS . . . . . 0.435 ' CB ' ' O ' ' X' ' 27' ' ' GLU . 14.9 ttmt -66.65 -46.98 73.99 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.218 -0.593 . . . . 0.0 110.575 -179.892 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 32' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -73.49 -32.86 64.51 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.118 -179.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' X' X ' 33' ' ' TYR . . . . . 0.43 ' CB ' ' O ' ' X' ' 29' ' ' VAL . 58.1 t80 -60.66 -46.09 91.63 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.141 -178.922 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 34' ' ' ALA . . . . . 0.482 ' O ' ' OD1' ' X' ' 37' ' ' ASN . . . -60.17 -36.42 77.55 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.649 -0.421 . . . . 0.0 110.171 -179.733 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 35' ' ' ASN . . . . . . . . . . . . . 5.7 t30 -71.18 -44.49 65.35 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 179.416 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' X' X ' 36' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -67.39 -32.77 73.9 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.827 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' X' X ' 37' ' ' ASN . . . . . 0.563 ' OD1' ' N ' ' X' ' 38' ' ' GLY . 24.5 p30 -79.23 -24.3 43.16 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 120.474 -0.49 . . . . 0.0 111.328 -178.832 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 38' ' ' GLY . . . . . 0.563 ' N ' ' OD1' ' X' ' 37' ' ' ASN . . . 130.87 -44.41 1.21 Allowed Glycine 0 CA--C 1.532 1.134 0 C-N-CA 121.257 -0.497 . . . . 0.0 112.738 178.601 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 39' ' ' VAL . . . . . . . . . . . . . 1.9 p -81.0 109.08 14.98 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 CA-C-N 117.403 0.601 . . . . 0.0 112.089 -178.114 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' X' X ' 40' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -128.19 111.02 12.98 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.49 178.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -143.52 -155.24 6.36 Favored Glycine 0 CA--C 1.533 1.202 0 C-N-CA 120.291 -0.957 . . . . 0.0 112.471 -179.298 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' X' X ' 42' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -74.37 141.64 45.13 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 -179.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' X' X ' 43' ' ' TRP . . . . . . . . . . . . . 83.6 m95 -104.99 162.37 13.41 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.897 0.856 . . . . 0.0 112.858 -177.829 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' X' X ' 44' ' ' THR . . . . . 0.498 ' CG2' ' OG1' ' X' ' 53' ' ' THR . 2.5 t -157.01 164.21 38.24 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 114.073 -1.421 . . . . 0.0 108.828 179.339 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 45' ' ' TYR . . . . . 0.62 ' CD1' ' CE1' ' X' ' 52' ' ' PHE . 3.0 t80 -175.03 134.53 0.34 Allowed 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 119.701 -0.8 . . . . 0.0 111.666 179.862 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 46' ' ' ASP . . . . . 0.514 ' N ' ' CD1' ' X' ' 45' ' ' TYR . 11.2 t0 -123.74 112.56 17.49 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 115.186 -0.916 . . . . 0.0 108.699 177.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 47' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -65.81 -15.63 63.06 Favored 'General case' 0 C--O 1.231 0.079 0 CA-C-O 120.698 0.285 . . . . 0.0 110.918 -179.674 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' X' X ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.33 -13.67 59.49 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.069 -179.729 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' X' X ' 49' ' ' THR . . . . . . . . . . . . . 2.7 p -128.29 3.14 5.73 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 121.436 -0.106 . . . . 0.0 110.725 -179.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' X' X ' 50' ' ' LYS . . . . . . . . . . . . . 68.6 mmtt 41.18 56.39 3.07 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 120.839 -0.344 . . . . 0.0 110.632 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' X' X ' 51' ' ' THR . . . . . . . . . . . . . 96.8 m -144.16 127.02 16.29 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 120.671 0.272 . . . . 0.0 111.456 -179.409 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' X' X ' 52' ' ' PHE . . . . . 0.62 ' CE1' ' CD1' ' X' ' 45' ' ' TYR . 15.9 m-85 -109.44 153.93 23.34 Favored 'General case' 0 C--N 1.343 0.295 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 179.109 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 53' ' ' THR . . . . . 0.498 ' OG1' ' CG2' ' X' ' 44' ' ' THR . 4.3 p -152.23 129.3 11.09 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 120.493 -0.483 . . . . 0.0 109.989 178.82 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 54' ' ' VAL . . . . . 0.425 ' O ' ' OD1' ' X' ' 8' ' ' ASN . 14.4 p -112.84 124.2 69.25 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 178.48 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 55' ' ' THR . . . . . 0.42 ' O ' ' CG2' ' X' ' 55' ' ' THR . 2.0 t -124.55 124.49 42.38 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.651 -178.085 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 56' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 . . . . . 0 C--O 1.221 -0.402 0 CA-C-O 117.968 -1.015 . . . . 0.0 110.09 179.465 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' X' X ' 2' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 . . . . . 0 N--CA 1.465 0.304 0 CA-C-O 120.879 0.371 . . . . 0.0 110.756 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' X' X ' 3' ' ' TYR . . . . . . . . . . . . . 92.0 m-85 -115.81 148.44 39.89 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.9 -0.591 . . . . 0.0 109.627 179.379 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' X' X ' 4' ' ' LYS . . . . . . . . . . . . . 45.5 tttp -119.27 127.81 53.58 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 120.927 0.394 . . . . 0.0 110.259 179.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' X' X ' 5' ' ' LEU . . . . . 0.444 ' CD1' ' C ' ' X' ' 5' ' ' LEU . 1.1 tm? -109.72 127.83 54.86 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.403 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 6' ' ' ILE . . . . . 0.402 ' N ' HD23 ' X' ' 5' ' ' LEU . 26.8 mm -98.91 132.34 44.41 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.349 0 CA-C-O 120.901 0.381 . . . . 0.0 110.15 -179.361 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 7' ' ' LEU . . . . . . . . . . . . . 6.3 mp -92.42 110.75 22.16 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.649 -179.131 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' X' X ' 8' ' ' ASN . . . . . 0.469 ' N ' ' OD1' ' X' ' 8' ' ' ASN . 6.3 p-10 -134.57 87.68 2.37 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 178.034 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 9' ' ' GLY . . . . . 0.751 ' H ' ' HZ3' ' X' ' 13' ' ' LYS . . . -123.89 -143.5 6.26 Favored Glycine 0 N--CA 1.464 0.552 0 N-CA-C 111.662 -0.575 . . . . 0.0 111.662 -179.158 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 10' ' ' LYS . . . . . . . . . . . . . 74.1 mttt -87.98 -53.17 4.87 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 111.818 0.303 . . . . 0.0 111.818 -179.274 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' X' X ' 11' ' ' THR . . . . . . . . . . . . . 41.4 p -130.29 21.83 5.23 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 -178.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' X' X ' 12' ' ' LEU . . . . . 0.711 ' N ' ' HZ2' ' X' ' 13' ' ' LYS . 0.6 OUTLIER -138.56 116.98 12.0 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 120.707 0.289 . . . . 0.0 110.725 -179.95 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' X' X ' 13' ' ' LYS . . . . . 0.751 ' HZ3' ' H ' ' X' ' 9' ' ' GLY . 0.3 OUTLIER -138.88 139.72 38.17 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.009 0.433 . . . . 0.0 110.749 179.889 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' X' X ' 14' ' ' GLY . . . . . 0.439 ' O ' ' OE1' ' X' ' 15' ' ' GLU . . . 174.17 -155.24 21.15 Favored Glycine 0 CA--C 1.533 1.17 0 N-CA-C 110.624 -0.991 . . . . 0.0 110.624 -179.913 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 15' ' ' GLU . . . . . 0.439 ' OE1' ' O ' ' X' ' 14' ' ' GLY . 5.2 mm-40 -133.83 150.87 51.42 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.863 0.332 . . . . 0.0 110.166 179.684 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 2.8 m -147.9 129.22 14.77 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 120.776 -0.37 . . . . 0.0 110.159 179.006 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' X' X ' 17' ' ' THR . . . . . . . . . . . . . 2.5 m -130.69 156.79 44.33 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 120.989 0.423 . . . . 0.0 110.544 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' X' X ' 18' ' ' THR . . . . . . . . . . . . . 7.6 t -148.91 152.88 37.17 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 115.881 -0.599 . . . . 0.0 109.545 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' X' X ' 19' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -104.21 105.55 15.73 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 -179.679 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' X' X ' 20' ' ' ALA . . . . . . . . . . . . . . . -136.66 163.12 31.32 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.69 -179.579 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' X' X ' 21' ' ' VAL . . . . . . . . . . . . . 1.1 p -88.56 -40.78 13.69 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.595 179.26 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' X' X ' 22' ' ' ASP . . . . . 0.426 ' OD1' ' N ' ' X' ' 23' ' ' ALA . 46.5 t0 -103.61 154.41 19.53 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.376 -179.247 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 23' ' ' ALA . . . . . 0.426 ' N ' ' OD1' ' X' ' 22' ' ' ASP . . . -75.08 -43.35 53.61 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.87 179.599 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.34 -39.79 94.59 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.595 -179.148 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' X' X ' 25' ' ' THR . . . . . . . . . . . . . 1.2 t -64.11 -34.2 77.51 Favored 'General case' 0 C--N 1.345 0.405 0 C-N-CA 120.665 -0.414 . . . . 0.0 110.572 -179.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' X' X ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.43 -35.88 78.26 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.877 0.37 . . . . 0.0 110.777 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' X' X ' 27' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -61.58 -28.02 69.05 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.859 -179.6 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' X' X ' 28' ' ' LYS . . . . . . . . . . . . . 83.8 mttt -56.8 -44.27 81.77 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.535 -0.466 . . . . 0.0 110.003 -179.025 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' X' X ' 29' ' ' VAL . . . . . 0.429 ' O ' ' CB ' ' X' ' 33' ' ' TYR . 11.5 t -70.15 -50.92 43.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.647 179.289 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 30' ' ' PHE . . . . . . . . . . . . . 55.0 m-85 -61.8 -43.53 98.67 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.111 -0.495 . . . . 0.0 112.009 -179.019 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' X' X ' 31' ' ' LYS . . . . . . . . . . . . . 67.5 mttt -70.47 -40.94 73.37 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 120.215 -0.594 . . . . 0.0 110.386 -179.627 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' X' X ' 32' ' ' GLN . . . . . . . . . . . . . 3.6 tp-100 -73.17 -33.55 65.52 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 179.168 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' X' X ' 33' ' ' TYR . . . . . 0.429 ' CB ' ' O ' ' X' ' 29' ' ' VAL . 29.2 t80 -66.76 -36.83 83.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.877 -179.848 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 34' ' ' ALA . . . . . 0.459 ' O ' ' OD1' ' X' ' 37' ' ' ASN . . . -59.38 -41.83 90.28 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.492 -179.188 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 35' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -66.67 -37.68 85.27 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 179.209 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 36' ' ' ASP . . . . . 0.491 ' OD1' ' N ' ' X' ' 36' ' ' ASP . 0.9 OUTLIER -67.71 -33.15 74.31 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.404 -0.816 . . . . 0.0 111.938 -179.908 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' X' X ' 37' ' ' ASN . . . . . 0.58 HD22 ' CG1' ' X' ' 39' ' ' VAL . 14.8 p-10 -90.59 -24.57 20.52 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 120.766 -0.374 . . . . 0.0 111.883 -178.301 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 38' ' ' GLY . . . . . 0.535 ' N ' ' OD1' ' X' ' 37' ' ' ASN . . . 118.92 -39.2 2.61 Favored Glycine 0 CA--C 1.533 1.2 0 C-N-CA 121.228 -0.51 . . . . 0.0 113.806 177.752 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 39' ' ' VAL . . . . . 0.58 ' CG1' HD22 ' X' ' 37' ' ' ASN . 1.5 p -80.24 108.29 13.51 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 CA-C-N 117.974 0.887 . . . . 0.0 111.549 -178.042 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 40' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -127.78 111.94 14.21 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 115.762 -0.654 . . . . 0.0 109.861 179.143 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' X' X ' 41' ' ' GLY . . . . . 0.461 ' H ' ' CG2' ' X' ' 54' ' ' VAL . . . -141.82 -154.96 6.3 Favored Glycine 0 CA--C 1.534 1.223 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.149 -179.464 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 42' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -74.98 137.34 41.5 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 110.092 -0.336 . . . . 0.0 110.092 -179.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' X' X ' 43' ' ' TRP . . . . . . . . . . . . . 82.1 m95 -102.97 161.88 13.39 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.767 0.794 . . . . 0.0 112.611 -178.45 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' X' X ' 44' ' ' THR . . . . . 0.481 ' CG2' ' OG1' ' X' ' 53' ' ' THR . 11.3 t -157.01 169.04 25.74 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.181 -1.372 . . . . 0.0 108.368 179.251 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 45' ' ' TYR . . . . . 0.612 ' CD1' ' CE1' ' X' ' 52' ' ' PHE . 3.0 t80 -174.43 135.27 0.42 Allowed 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 119.597 -0.841 . . . . 0.0 111.819 -179.951 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 46' ' ' ASP . . . . . 0.517 ' N ' ' CD1' ' X' ' 45' ' ' TYR . 14.8 t0 -123.68 112.5 17.46 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 115.206 -0.907 . . . . 0.0 108.804 177.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 47' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -66.56 -14.94 63.01 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-O 120.775 0.321 . . . . 0.0 110.831 -179.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' X' X ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.34 -14.53 58.92 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.082 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' X' X ' 49' ' ' THR . . . . . . . . . . . . . 2.7 p -128.27 3.33 5.74 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 121.475 -0.09 . . . . 0.0 110.888 -179.737 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' X' X ' 50' ' ' LYS . . . . . . . . . . . . . 68.7 mmtt 41.63 56.7 3.25 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 120.799 -0.36 . . . . 0.0 110.546 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' X' X ' 51' ' ' THR . . . . . . . . . . . . . 86.3 m -146.24 127.84 15.15 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 120.775 0.322 . . . . 0.0 111.828 -179.303 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' X' X ' 52' ' ' PHE . . . . . 0.612 ' CE1' ' CD1' ' X' ' 45' ' ' TYR . 11.0 m-85 -108.2 155.29 20.62 Favored 'General case' 0 C--N 1.343 0.301 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 178.725 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 53' ' ' THR . . . . . 0.481 ' OG1' ' CG2' ' X' ' 44' ' ' THR . 58.8 p -150.97 130.54 13.02 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 120.513 -0.475 . . . . 0.0 110.396 179.277 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 54' ' ' VAL . . . . . 0.461 ' CG2' ' H ' ' X' ' 41' ' ' GLY . 11.4 p -113.58 123.89 69.68 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.408 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 179.243 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 55' ' ' THR . . . . . 0.451 ' CG2' ' O ' ' X' ' 55' ' ' THR . 4.2 t -125.31 120.39 31.03 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.403 -178.715 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 56' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 . . . . . 0 C--O 1.219 -0.517 0 CA-C-O 118.117 -0.944 . . . . 0.0 110.094 179.567 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' X' X ' 2' ' ' GLN . . . . . . . . . . . . . 80.0 mt-30 . . . . . 0 N--CA 1.467 0.402 0 CA-C-O 120.961 0.41 . . . . 0.0 111.312 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' X' X ' 3' ' ' TYR . . . . . 0.636 ' CD1' ' N ' ' X' ' 3' ' ' TYR . 0.1 OUTLIER -119.87 168.74 10.81 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 178.866 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' X' X ' 4' ' ' LYS . . . . . . . . . . . . . 28.7 tttm -135.86 128.78 31.29 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 121.062 -0.255 . . . . 0.0 110.566 -179.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 5' ' ' LEU . . . . . 0.507 HD23 ' N ' ' X' ' 6' ' ' ILE . 1.7 tm? -105.79 126.26 51.96 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 179.633 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' X' X ' 6' ' ' ILE . . . . . 0.507 ' N ' HD23 ' X' ' 5' ' ' LEU . 32.9 mm -98.14 132.54 42.91 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.452 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 179.393 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' X' X ' 7' ' ' LEU . . . . . . . . . . . . . 5.7 mp -92.21 115.25 27.92 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.652 -179.536 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 8' ' ' ASN . . . . . 0.665 ' ND2' ' HG1' ' X' ' 55' ' ' THR . 35.1 t30 -134.55 87.52 2.36 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 177.863 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' X' X ' 9' ' ' GLY . . . . . 0.451 ' H ' ' HD3' ' X' ' 13' ' ' LYS . . . -126.85 -163.0 11.37 Favored Glycine 0 C--N 1.336 0.541 0 N-CA-C 111.291 -0.724 . . . . 0.0 111.291 -179.096 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' X' X ' 10' ' ' LYS . . . . . . . . . . . . . 40.5 mtmt -80.55 -43.02 21.34 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.938 -0.305 . . . . 0.0 110.937 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 11' ' ' THR . . . . . . . . . . . . . 42.3 p -130.54 15.78 5.43 Favored 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 112.3 0.482 . . . . 0.0 112.3 -179.195 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 12' ' ' LEU . . . . . 0.726 ' N ' ' HZ3' ' X' ' 13' ' ' LYS . 0.3 OUTLIER -138.52 100.44 4.09 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 120.842 -0.343 . . . . 0.0 111.642 -179.526 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' X' X ' 13' ' ' LYS . . . . . 0.726 ' HZ3' ' N ' ' X' ' 12' ' ' LEU . 0.0 OUTLIER -122.44 137.77 54.76 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 178.829 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' X' X ' 14' ' ' GLY . . . . . . . . . . . . . . . 173.17 -154.6 20.85 Favored Glycine 0 CA--C 1.533 1.184 0 N-CA-C 111.082 -0.807 . . . . 0.0 111.082 -179.73 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 15' ' ' GLU . . . . . . . . . . . . . 56.8 mm-40 -131.8 152.74 50.76 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.595 0.236 . . . . 0.0 110.469 179.613 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 16' ' ' THR . . . . . 0.414 ' OG1' ' O ' ' X' ' 5' ' ' LEU . 0.2 OUTLIER -148.23 154.85 40.62 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 120.969 0.414 . . . . 0.0 110.441 179.716 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' X' X ' 17' ' ' THR . . . . . . . . . . . . . 2.0 m -145.96 158.93 43.86 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.737 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 18' ' ' THR . . . . . . . . . . . . . 4.4 t -153.08 151.2 29.94 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-N 116.203 -0.453 . . . . 0.0 109.885 179.069 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 19' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -106.55 110.81 23.12 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.089 179.769 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' X' X ' 20' ' ' ALA . . . . . . . . . . . . . . . -147.57 162.12 39.75 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.055 0.455 . . . . 0.0 110.597 179.766 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 21' ' ' VAL . . . . . . . . . . . . . 1.1 p -87.0 -41.38 14.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.717 179.561 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 22' ' ' ASP . . . . . . . . . . . . . 68.6 m-20 -103.86 151.82 22.66 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.482 -179.033 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.43 -37.46 63.31 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.298 -0.864 . . . . 0.0 110.872 179.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 24' ' ' ALA . . . . . . . . . . . . . . . -70.49 -38.23 74.33 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.332 -179.197 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 25' ' ' THR . . . . . . . . . . . . . 1.1 t -67.29 -29.82 69.52 Favored 'General case' 0 C--N 1.345 0.408 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.621 -179.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.55 -35.77 79.69 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.495 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 27' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -58.31 -30.4 66.63 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.579 -179.771 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 28' ' ' LYS . . . . . . . . . . . . . 41.7 mtmt -57.34 -39.52 76.09 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.472 -0.491 . . . . 0.0 110.181 -178.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 29' ' ' VAL . . . . . 0.415 ' O ' ' CB ' ' X' ' 33' ' ' TYR . 13.0 t -70.02 -51.47 39.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.543 179.33 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' X' X ' 30' ' ' PHE . . . . . . . . . . . . . 40.8 m-85 -64.59 -42.97 95.25 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.859 -179.412 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 31' ' ' LYS . . . . . . . . . . . . . 2.8 tppt? -61.46 -49.2 77.75 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 120.282 -0.567 . . . . 0.0 110.78 -179.478 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 32' ' ' GLN . . . . . . . . . . . . . 89.6 mt-30 -73.08 -38.36 66.44 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.838 -179.746 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 33' ' ' TYR . . . . . 0.528 ' CZ ' ' OD1' ' X' ' 37' ' ' ASN . 69.8 t80 -61.8 -37.47 84.51 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.645 -179.797 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' X' X ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.27 -38.06 79.17 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.39 -179.325 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 35' ' ' ASN . . . . . . . . . . . . . 10.0 m-20 -61.18 -48.17 82.78 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 179.504 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 36' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -66.81 -24.7 66.2 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.02 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 37' ' ' ASN . . . . . 0.528 ' OD1' ' CZ ' ' X' ' 33' ' ' TYR . 1.0 OUTLIER -87.27 -26.08 23.63 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 116.471 -0.332 . . . . 0.0 110.996 -178.943 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' X' X ' 38' ' ' GLY . . . . . . . . . . . . . . . 106.08 -36.91 4.1 Favored Glycine 0 CA--C 1.53 1.019 0 C-N-CA 121.359 -0.448 . . . . 0.0 112.563 178.626 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 39' ' ' VAL . . . . . 0.406 ' H ' HG11 ' X' ' 39' ' ' VAL . 3.1 p -79.96 107.74 12.68 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.39 0 CA-C-N 117.575 0.687 . . . . 0.0 110.983 -179.096 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' X' X ' 40' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -128.12 110.83 12.83 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.888 179.358 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 41' ' ' GLY . . . . . 0.447 ' H ' ' CG2' ' X' ' 54' ' ' VAL . . . -141.86 -155.72 6.56 Favored Glycine 0 CA--C 1.531 1.064 0 C-N-CA 120.683 -0.77 . . . . 0.0 111.943 -179.69 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' X' X ' 42' ' ' GLU . . . . . . . . . . . . . 10.9 mt-10 -74.99 133.62 41.65 Favored 'General case' 0 N--CA 1.446 -0.631 0 N-CA-C 110.129 -0.323 . . . . 0.0 110.129 -179.803 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 43' ' ' TRP . . . . . . . . . . . . . 90.6 m95 -99.19 162.36 13.1 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.476 0.655 . . . . 0.0 111.892 -178.541 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 44' ' ' THR . . . . . 0.507 ' CG2' ' OG1' ' X' ' 53' ' ' THR . 2.5 t -156.9 167.11 31.46 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 114.845 -1.071 . . . . 0.0 109.492 179.783 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' X' X ' 45' ' ' TYR . . . . . 0.63 ' CD1' ' CZ ' ' X' ' 52' ' ' PHE . 64.7 t80 -166.52 136.7 3.24 Favored 'General case' 0 CA--C 1.519 -0.241 0 C-N-CA 120.116 -0.634 . . . . 0.0 111.958 179.739 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' X' X ' 46' ' ' ASP . . . . . . . . . . . . . 18.8 t0 -123.44 111.79 16.76 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 177.523 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 47' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -67.11 -15.74 63.9 Favored 'General case' 0 C--O 1.231 0.095 0 CA-C-O 120.882 0.372 . . . . 0.0 110.751 -179.708 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.35 -18.09 53.17 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.115 -179.698 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 49' ' ' THR . . . . . . . . . . . . . 2.6 p -128.2 2.74 5.79 Favored 'General case' 0 N--CA 1.469 0.521 0 N-CA-C 110.626 -0.139 . . . . 0.0 110.626 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 50' ' ' LYS . . . . . . . . . . . . . 65.7 mmtt 39.64 55.69 2.39 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-O 120.583 0.23 . . . . 0.0 110.712 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 51' ' ' THR . . . . . . . . . . . . . 99.7 m -138.31 129.65 27.48 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.018 -179.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 52' ' ' PHE . . . . . 0.63 ' CZ ' ' CD1' ' X' ' 45' ' ' TYR . 87.3 m-85 -107.29 154.26 21.52 Favored 'General case' 0 C--N 1.342 0.281 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 179.46 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' X' X ' 53' ' ' THR . . . . . 0.507 ' OG1' ' CG2' ' X' ' 44' ' ' THR . 24.2 p -151.9 130.44 12.23 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 120.599 -0.44 . . . . 0.0 110.253 178.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' X' X ' 54' ' ' VAL . . . . . 0.447 ' CG2' ' H ' ' X' ' 41' ' ' GLY . 10.6 p -113.42 123.7 69.33 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 178.871 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' X' X ' 55' ' ' THR . . . . . 0.665 ' HG1' ' ND2' ' X' ' 8' ' ' ASN . 4.8 t -125.35 120.7 31.84 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.511 -178.425 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' X' X ' 56' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 . . . . . 0 C--O 1.22 -0.461 0 CA-C-O 118.073 -0.965 . . . . 0.0 110.136 179.252 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' X' X ' 2' ' ' GLN . . . . . . . . . . . . . 15.5 mm-40 . . . . . 0 N--CA 1.468 0.463 0 CA-C-O 121.049 0.452 . . . . 0.0 110.92 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' X' X ' 3' ' ' TYR . . . . . 0.455 ' HH ' ' HZ2' ' X' ' 50' ' ' LYS . 38.1 m-85 -125.61 137.01 53.87 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.771 -0.65 . . . . 0.0 109.412 179.17 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' X' X ' 4' ' ' LYS . . . . . . . . . . . . . 44.8 tttp -119.97 128.06 53.22 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 120.923 0.392 . . . . 0.0 110.703 -179.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 5' ' ' LEU . . . . . 0.446 ' CD1' ' C ' ' X' ' 5' ' ' LEU . 1.0 OUTLIER -109.29 127.94 54.69 Favored 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 179.435 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' X' X ' 6' ' ' ILE . . . . . 0.406 ' N ' HD21 ' X' ' 5' ' ' LEU . 27.0 mm -98.99 132.35 44.51 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 CA-C-O 120.948 0.404 . . . . 0.0 110.176 -179.386 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' X' X ' 7' ' ' LEU . . . . . . . . . . . . . 6.0 mp -92.66 110.24 21.66 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.664 -179.19 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 8' ' ' ASN . . . . . . . . . . . . . 12.7 t30 -132.91 87.52 2.41 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 178.298 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 9' ' ' GLY . . . . . 0.725 ' H ' ' HZ2' ' X' ' 13' ' ' LYS . . . -122.79 -147.35 7.39 Favored Glycine 0 N--CA 1.464 0.537 0 N-CA-C 111.462 -0.655 . . . . 0.0 111.462 -179.203 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' X' X ' 10' ' ' LYS . . . . . . . . . . . . . 57.1 mttt -79.17 -50.15 11.43 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 120.989 -0.284 . . . . 0.0 111.46 -179.486 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 11' ' ' THR . . . . . . . . . . . . . 41.5 p -130.35 -19.62 3.09 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 -179.427 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 12' ' ' LEU . . . . . 0.673 ' N ' ' HZ1' ' X' ' 13' ' ' LYS . 0.5 OUTLIER -92.15 119.51 31.87 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-O 120.648 0.261 . . . . 0.0 111.156 -178.943 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' X' X ' 13' ' ' LYS . . . . . 0.725 ' HZ2' ' H ' ' X' ' 9' ' ' GLY . 0.1 OUTLIER -140.18 139.24 35.66 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 120.907 0.384 . . . . 0.0 110.255 179.449 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' X' X ' 14' ' ' GLY . . . . . 0.438 ' O ' ' OE1' ' X' ' 15' ' ' GLU . . . 173.79 -155.01 21.13 Favored Glycine 0 CA--C 1.533 1.216 0 N-CA-C 110.671 -0.972 . . . . 0.0 110.671 -179.933 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' X' X ' 15' ' ' GLU . . . . . 0.438 ' OE1' ' O ' ' X' ' 14' ' ' GLY . 5.0 mm-40 -133.82 151.09 51.46 Favored 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 110.098 -0.334 . . . . 0.0 110.098 179.622 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 2.8 m -147.86 129.18 14.78 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.052 178.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 17' ' ' THR . . . . . . . . . . . . . 2.4 m -129.47 157.05 43.08 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-O 121.003 0.43 . . . . 0.0 110.551 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 18' ' ' THR . . . . . . . . . . . . . 7.2 t -150.55 152.69 34.52 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.601 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 19' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -104.42 105.61 15.8 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.846 -0.427 . . . . 0.0 109.846 -179.626 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 20' ' ' ALA . . . . . . . . . . . . . . . -136.39 163.29 30.79 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.728 -179.668 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 21' ' ' VAL . . . . . . . . . . . . . 1.1 p -89.04 -41.23 13.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.358 179.356 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 22' ' ' ASP . . . . . . . . . . . . . 46.5 t0 -102.27 152.71 20.74 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.335 -179.267 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 23' ' ' ALA . . . . . . . . . . . . . . . -75.14 -39.68 60.28 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.73 179.645 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 24' ' ' ALA . . . . . . . . . . . . . . . -67.51 -39.84 85.12 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.332 -179.087 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 25' ' ' THR . . . . . . . . . . . . . 1.2 t -64.24 -33.33 75.57 Favored 'General case' 0 C--N 1.345 0.409 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.62 -179.73 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.12 -35.99 79.01 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.973 0.416 . . . . 0.0 110.681 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 27' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -62.88 -28.43 70.03 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.594 -179.607 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 28' ' ' LYS . . . . . . . . . . . . . 83.5 mttt -57.17 -43.77 82.9 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 120.588 -0.445 . . . . 0.0 109.805 -179.163 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 29' ' ' VAL . . . . . 0.451 ' O ' ' N ' ' X' ' 33' ' ' TYR . 11.9 t -70.24 -50.88 43.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.588 179.296 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' X' X ' 30' ' ' PHE . . . . . . . . . . . . . 56.0 m-85 -61.76 -43.93 97.88 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.181 -0.463 . . . . 0.0 112.011 -179.236 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 31' ' ' LYS . . . . . . . . . . . . . 69.7 mttt -69.26 -41.76 76.48 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 120.173 -0.611 . . . . 0.0 110.281 -179.794 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 32' ' ' GLN . . . . . . . . . . . . . 59.6 tp60 -73.2 -33.14 65.22 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.038 0.447 . . . . 0.0 110.039 179.226 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 33' ' ' TYR . . . . . 0.451 ' N ' ' O ' ' X' ' 29' ' ' VAL . 69.3 t80 -71.23 -42.18 69.2 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.12 -179.794 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' X' X ' 34' ' ' ALA . . . . . . . . . . . . . . . -58.73 -38.08 77.58 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 120.839 -0.344 . . . . 0.0 110.4 -179.09 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 35' ' ' ASN . . . . . . . . . . . . . 40.3 t-20 -63.19 -45.54 91.27 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 179.042 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 36' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -66.81 -25.02 66.25 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.622 179.415 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 37' ' ' ASN . . . . . 0.407 ' ND2' ' CE2' ' X' ' 33' ' ' TYR . 0.9 OUTLIER -85.09 -26.53 26.89 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.983 -178.839 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' X' X ' 38' ' ' GLY . . . . . . . . . . . . . . . 113.19 -37.91 3.43 Favored Glycine 0 CA--C 1.531 1.052 0 C-N-CA 121.541 -0.362 . . . . 0.0 112.973 178.354 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 39' ' ' VAL . . . . . . . . . . . . . 1.5 p -80.63 108.64 14.22 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.394 0 CA-C-N 117.73 0.765 . . . . 0.0 111.161 -178.551 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 40' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -127.42 110.85 13.2 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.677 179.172 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 41' ' ' GLY . . . . . 0.439 ' H ' ' CG2' ' X' ' 54' ' ' VAL . . . -142.26 -155.17 6.35 Favored Glycine 0 CA--C 1.532 1.11 0 C-N-CA 120.606 -0.807 . . . . 0.0 111.981 -179.407 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' X' X ' 42' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -75.12 132.06 40.95 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-O 120.885 0.374 . . . . 0.0 110.152 -179.699 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 43' ' ' TRP . . . . . . . . . . . . . 81.5 m95 -97.92 161.41 13.75 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.65 0.738 . . . . 0.0 112.05 -178.672 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 44' ' ' THR . . . . . 0.502 ' CG2' ' OG1' ' X' ' 53' ' ' THR . 2.5 t -157.0 169.07 25.66 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 114.509 -1.223 . . . . 0.0 108.885 179.483 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' X' X ' 45' ' ' TYR . . . . . 0.615 ' CD1' ' CE1' ' X' ' 52' ' ' PHE . 2.6 t80 -173.9 135.55 0.5 Allowed 'General case' 0 C--N 1.331 -0.21 0 C-N-CA 119.697 -0.801 . . . . 0.0 111.691 -179.917 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' X' X ' 46' ' ' ASP . . . . . 0.539 ' N ' ' CD1' ' X' ' 45' ' ' TYR . 8.1 t0 -123.84 112.6 17.47 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 115.155 -0.929 . . . . 0.0 108.872 178.067 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' X' X ' 47' ' ' ASP . . . . . 0.511 ' OD1' ' NZ ' ' X' ' 50' ' ' LYS . 25.0 t0 -66.47 -15.48 63.38 Favored 'General case' 0 C--O 1.23 0.057 0 CA-C-O 120.728 0.299 . . . . 0.0 110.856 -179.722 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' X' X ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.51 -14.88 58.57 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.069 -179.702 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 49' ' ' THR . . . . . . . . . . . . . 2.7 p -128.28 3.84 5.75 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 121.394 -0.122 . . . . 0.0 110.792 -179.656 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 50' ' ' LYS . . . . . 0.511 ' NZ ' ' OD1' ' X' ' 47' ' ' ASP . 64.3 mmtt 40.89 57.34 2.74 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 120.922 -0.311 . . . . 0.0 110.693 -179.885 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' X' X ' 51' ' ' THR . . . . . . . . . . . . . 85.1 m -146.62 127.88 14.81 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 120.725 0.298 . . . . 0.0 111.747 -179.435 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 52' ' ' PHE . . . . . 0.615 ' CE1' ' CD1' ' X' ' 45' ' ' TYR . 10.5 m-85 -107.64 154.11 21.92 Favored 'General case' 0 C--N 1.342 0.261 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 178.749 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' X' X ' 53' ' ' THR . . . . . 0.502 ' OG1' ' CG2' ' X' ' 44' ' ' THR . 36.4 p -150.97 130.36 12.88 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 120.447 -0.501 . . . . 0.0 110.187 179.07 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' X' X ' 54' ' ' VAL . . . . . 0.439 ' CG2' ' H ' ' X' ' 41' ' ' GLY . 14.4 p -113.51 123.92 69.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 179.192 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' X' X ' 55' ' ' THR . . . . . 0.437 ' CG2' ' O ' ' X' ' 55' ' ' THR . 4.3 t -125.24 121.38 33.91 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.525 -178.599 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' X' X ' 56' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 . . . . . 0 C--O 1.219 -0.533 0 CA-C-O 118.067 -0.968 . . . . 0.0 110.035 179.499 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' X' X ' 2' ' ' GLN . . . . . . . . . . . . . 83.6 mt-30 . . . . . 0 N--CA 1.465 0.314 0 CA-C-O 121.004 0.43 . . . . 0.0 111.51 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' X' X ' 3' ' ' TYR . . . . . . . . . . . . . 62.6 m-85 -116.93 139.63 50.42 Favored 'General case' 0 CA--C 1.517 -0.303 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 178.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 4' ' ' LYS . . . . . . . . . . . . . 52.3 tttp -120.93 127.83 52.19 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-O 120.911 0.386 . . . . 0.0 110.925 -179.3 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 5' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -105.01 129.0 53.56 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 179.08 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 6' ' ' ILE . . . . . . . . . . . . . 32.1 mm -100.94 129.79 51.31 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.419 0 N-CA-C 109.63 -0.508 . . . . 0.0 109.63 178.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 7' ' ' LEU . . . . . 0.506 ' CD1' ' HG1' ' X' ' 16' ' ' THR . 5.1 mp -93.43 110.04 21.61 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.771 -179.587 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 8' ' ' ASN . . . . . 0.523 ' N ' ' OD1' ' X' ' 8' ' ' ASN . 5.1 p-10 -134.83 87.36 2.33 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 178.039 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 9' ' ' GLY . . . . . 0.764 ' H ' ' HZ1' ' X' ' 13' ' ' LYS . . . -122.24 -145.84 7.13 Favored Glycine 0 N--CA 1.464 0.546 0 N-CA-C 111.527 -0.629 . . . . 0.0 111.527 -179.302 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 10' ' ' LYS . . . . . . . . . . . . . 41.2 mtmt -80.61 -49.49 11.21 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 121.157 -0.217 . . . . 0.0 111.551 -179.381 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 11' ' ' THR . . . . . . . . . . . . . 41.6 p -129.97 -19.45 3.24 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -179.34 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 12' ' ' LEU . . . . . 0.679 ' N ' ' HZ3' ' X' ' 13' ' ' LYS . 0.4 OUTLIER -93.12 119.18 32.05 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 120.624 0.249 . . . . 0.0 111.066 -178.954 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' X' X ' 13' ' ' LYS . . . . . 0.764 ' HZ1' ' H ' ' X' ' 9' ' ' GLY . 0.1 OUTLIER -141.52 139.21 33.19 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-O 120.974 0.416 . . . . 0.0 110.351 179.351 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' X' X ' 14' ' ' GLY . . . . . 0.438 ' O ' ' OE1' ' X' ' 15' ' ' GLU . . . 173.62 -155.11 21.52 Favored Glycine 0 CA--C 1.533 1.195 0 N-CA-C 110.771 -0.932 . . . . 0.0 110.771 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 15' ' ' GLU . . . . . 0.438 ' OE1' ' O ' ' X' ' 14' ' ' GLY . 6.6 mm-40 -129.72 154.64 46.97 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.85 0.357 . . . . 0.0 110.218 179.553 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 16' ' ' THR . . . . . 0.506 ' HG1' ' CD1' ' X' ' 7' ' ' LEU . 0.0 OUTLIER -147.54 145.47 29.09 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.067 179.797 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' X' X ' 17' ' ' THR . . . . . . . . . . . . . 1.8 m -146.11 157.25 43.84 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.943 0.401 . . . . 0.0 111.048 179.23 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 18' ' ' THR . . . . . . . . . . . . . 7.4 t -155.24 152.9 29.86 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.102 179.636 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 19' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -104.42 105.91 16.21 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 179.805 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 20' ' ' ALA . . . . . . . . . . . . . . . -130.64 159.01 38.48 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 121.107 0.48 . . . . 0.0 110.793 -179.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 21' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -82.14 -41.09 17.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.316 179.118 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 22' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -111.56 157.3 20.53 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.131 -179.45 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.88 -42.92 56.93 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.659 -0.701 . . . . 0.0 111.133 179.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 24' ' ' ALA . . . . . . . . . . . . . . . -66.34 -41.38 89.66 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.563 -178.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 25' ' ' THR . . . . . . . . . . . . . 1.2 t -59.63 -35.61 74.72 Favored 'General case' 0 C--N 1.345 0.406 0 C-N-CA 120.734 -0.386 . . . . 0.0 110.716 -179.619 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.85 -35.02 77.84 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.924 0.392 . . . . 0.0 110.655 -179.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 27' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -57.25 -29.32 63.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.806 -179.317 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 28' ' ' LYS . . . . . . . . . . . . . 41.8 mtmt -57.34 -43.85 83.77 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.234 -178.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 29' ' ' VAL . . . . . 0.444 ' O ' ' CB ' ' X' ' 33' ' ' TYR . 19.1 t -69.47 -46.35 76.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.174 179.168 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 30' ' ' PHE . . . . . . . . . . . . . 8.4 m-30 -61.52 -43.41 98.91 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.308 -179.621 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 31' ' ' LYS . . . . . . . . . . . . . 2.4 tppt? -63.14 -50.1 71.76 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 120.335 -0.546 . . . . 0.0 110.763 -179.459 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 32' ' ' GLN . . . . . . . . . . . . . 93.7 mm-40 -73.52 -34.44 65.24 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.317 -179.659 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 33' ' ' TYR . . . . . 0.521 ' CZ ' ' OD1' ' X' ' 37' ' ' ASN . 69.0 t80 -61.74 -43.48 98.78 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.88 -179.535 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.11 -37.63 77.65 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.421 -179.082 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 35' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -64.18 -47.22 80.65 Favored 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 179.221 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 36' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -66.87 -26.08 66.72 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.645 179.602 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 37' ' ' ASN . . . . . 0.521 ' OD1' ' CZ ' ' X' ' 33' ' ' TYR . 1.1 m120 -84.0 -26.66 28.99 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.807 -179.283 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 38' ' ' GLY . . . . . . . . . . . . . . . 112.15 -39.25 2.93 Favored Glycine 0 CA--C 1.531 1.076 0 C-N-CA 121.555 -0.355 . . . . 0.0 112.364 178.622 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 39' ' ' VAL . . . . . . . . . . . . . 1.6 p -80.78 108.75 14.46 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 CA-C-N 117.4 0.6 . . . . 0.0 111.211 -178.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 40' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -127.71 112.31 14.67 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.737 179.306 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 41' ' ' GLY . . . . . 0.405 ' H ' ' CG2' ' X' ' 54' ' ' VAL . . . -142.92 -153.73 5.96 Favored Glycine 0 CA--C 1.533 1.197 0 C-N-CA 120.337 -0.935 . . . . 0.0 112.283 -179.431 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 42' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -74.53 139.13 43.58 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 -179.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 43' ' ' TRP . . . . . . . . . . . . . 90.8 m95 -102.83 162.36 12.99 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.817 0.817 . . . . 0.0 112.686 -178.052 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 44' ' ' THR . . . . . 0.5 ' CG2' ' OG1' ' X' ' 53' ' ' THR . 2.8 t -156.9 167.85 29.23 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.35 -1.295 . . . . 0.0 108.821 179.206 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 45' ' ' TYR . . . . . 0.629 ' CD1' ' CE1' ' X' ' 52' ' ' PHE . 19.1 t80 -172.88 134.45 0.59 Allowed 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 119.748 -0.781 . . . . 0.0 111.771 179.992 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 46' ' ' ASP . . . . . 0.414 ' OD2' ' OG1' ' X' ' 49' ' ' THR . 11.6 t0 -123.66 112.33 17.27 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 115.25 -0.886 . . . . 0.0 108.708 177.87 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 47' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -68.61 -16.33 63.81 Favored 'General case' 0 C--O 1.231 0.121 0 CA-C-O 120.815 0.341 . . . . 0.0 110.988 -179.552 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.16 -13.56 59.64 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.101 -179.824 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 49' ' ' THR . . . . . 0.414 ' OG1' ' OD2' ' X' ' 46' ' ' ASP . 2.5 p -128.22 3.0 5.77 Favored 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 110.508 -0.182 . . . . 0.0 110.508 -179.793 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 50' ' ' LYS . . . . . . . . . . . . . 64.5 mmtt 41.54 57.48 2.99 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 120.908 -0.317 . . . . 0.0 110.544 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 51' ' ' THR . . . . . . . . . . . . . 96.9 m -147.01 128.67 15.17 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 111.891 0.33 . . . . 0.0 111.891 -179.346 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 52' ' ' PHE . . . . . 0.629 ' CE1' ' CD1' ' X' ' 45' ' ' TYR . 27.9 m-85 -107.84 156.23 19.39 Favored 'General case' 0 C--N 1.345 0.376 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 178.717 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 53' ' ' THR . . . . . 0.5 ' OG1' ' CG2' ' X' ' 44' ' ' THR . 11.6 p -152.14 128.83 10.82 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 178.767 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 54' ' ' VAL . . . . . 0.405 ' CG2' ' H ' ' X' ' 41' ' ' GLY . 10.4 p -112.74 123.98 68.95 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 178.776 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 55' ' ' THR . . . . . 0.425 ' CG2' ' O ' ' X' ' 55' ' ' THR . 3.0 t -124.93 123.27 39.54 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 116.561 -0.291 . . . . 0.0 111.708 -178.053 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 56' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 . . . . . 0 C--O 1.22 -0.494 0 CA-C-O 118.015 -0.993 . . . . 0.0 110.062 179.36 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' X' X ' 2' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 . . . . . 0 N--CA 1.465 0.304 0 CA-C-O 120.908 0.385 . . . . 0.0 110.622 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' X' X ' 3' ' ' TYR . . . . . . . . . . . . . 73.5 m-85 -115.3 142.66 46.38 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.463 179.462 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 4' ' ' LYS . . . . . . . . . . . . . 10.1 ttmm -119.45 127.2 52.86 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 121.024 0.44 . . . . 0.0 110.187 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 5' ' ' LEU . . . . . 0.44 ' CD1' ' C ' ' X' ' 5' ' ' LEU . 1.0 OUTLIER -107.8 127.64 53.89 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 179.664 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' X' X ' 6' ' ' ILE . . . . . 0.402 ' N ' HD23 ' X' ' 5' ' ' LEU . 29.2 mm -98.4 132.24 43.9 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.467 0 CA-C-O 120.907 0.384 . . . . 0.0 110.073 -179.474 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 7' ' ' LEU . . . . . . . . . . . . . 6.2 mp -91.91 113.62 25.94 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.283 -179.156 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 8' ' ' ASN . . . . . 0.534 ' ND2' ' HG1' ' X' ' 55' ' ' THR . 20.2 t30 -131.78 87.73 2.48 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 178.165 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 9' ' ' GLY . . . . . 0.535 ' H ' ' NZ ' ' X' ' 13' ' ' LYS . . . -124.62 -163.24 11.62 Favored Glycine 0 N--CA 1.463 0.48 0 N-CA-C 111.542 -0.623 . . . . 0.0 111.542 -178.68 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 10' ' ' LYS . . . . . . . . . . . . . 55.5 mttt -75.94 -48.86 19.56 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 120.86 -0.336 . . . . 0.0 110.982 -179.692 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 11' ' ' THR . . . . . . . . . . . . . 41.3 p -130.73 19.3 5.12 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 112.177 0.436 . . . . 0.0 112.177 -179.301 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 12' ' ' LEU . . . . . 0.708 ' H ' ' HZ2' ' X' ' 13' ' ' LYS . 0.5 OUTLIER -138.4 108.12 6.26 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 120.848 0.356 . . . . 0.0 111.337 -179.435 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' X' X ' 13' ' ' LYS . . . . . 0.708 ' HZ2' ' H ' ' X' ' 12' ' ' LEU . 0.2 OUTLIER -131.78 139.94 49.06 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.264 179.429 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' X' X ' 14' ' ' GLY . . . . . . . . . . . . . . . 174.6 -155.19 20.59 Favored Glycine 0 CA--C 1.535 1.323 0 N-CA-C 110.839 -0.905 . . . . 0.0 110.839 -179.794 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 15' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -134.4 149.94 50.84 Favored 'General case' 0 N--CA 1.468 0.449 0 O-C-N 122.717 -0.284 . . . . 0.0 110.517 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 2.7 m -148.28 129.5 14.64 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 120.88 -0.328 . . . . 0.0 110.343 178.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 17' ' ' THR . . . . . . . . . . . . . 2.6 m -131.66 157.24 44.23 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 120.92 0.39 . . . . 0.0 110.451 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 18' ' ' THR . . . . . . . . . . . . . 7.1 t -152.67 152.81 32.17 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.087 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 19' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -104.2 105.86 16.16 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.785 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 20' ' ' ALA . . . . . . . . . . . . . . . -130.01 162.64 28.24 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.998 -179.336 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 21' ' ' VAL . . . . . . . . . . . . . 1.2 p -82.98 -37.58 13.95 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.268 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.716 179.515 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 22' ' ' ASP . . . . . 0.509 ' OD1' ' N ' ' X' ' 23' ' ' ALA . 33.0 t0 -115.47 156.25 25.99 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.943 -179.532 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 23' ' ' ALA . . . . . 0.509 ' N ' ' OD1' ' X' ' 22' ' ' ASP . . . -74.94 -42.78 57.01 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.026 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 24' ' ' ALA . . . . . . . . . . . . . . . -65.71 -39.26 91.01 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.669 -179.054 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 25' ' ' THR . . . . . . . . . . . . . 1.2 t -63.21 -34.57 77.93 Favored 'General case' 0 C--N 1.346 0.437 0 C-N-CA 120.669 -0.413 . . . . 0.0 110.7 -179.561 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.0 -35.82 78.96 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.904 0.383 . . . . 0.0 110.73 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 27' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -58.27 -29.08 65.53 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.665 -179.779 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 28' ' ' LYS . . . . . 0.416 ' O ' ' OE1' ' X' ' 32' ' ' GLN . 41.4 mtmt -57.22 -43.49 82.86 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 120.456 -0.498 . . . . 0.0 110.031 -179.079 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 29' ' ' VAL . . . . . 0.43 ' O ' ' CB ' ' X' ' 33' ' ' TYR . 12.1 t -69.95 -50.76 45.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.459 179.394 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 30' ' ' PHE . . . . . . . . . . . . . 57.9 m-85 -61.54 -43.15 99.39 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.878 -179.319 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 31' ' ' LYS . . . . . . . . . . . . . 68.1 mttt -70.52 -41.78 72.14 Favored 'General case' 0 C--O 1.232 0.155 0 C-N-CA 120.23 -0.588 . . . . 0.0 110.55 -179.499 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 32' ' ' GLN . . . . . 0.416 ' OE1' ' O ' ' X' ' 28' ' ' LYS . 79.2 mt-30 -73.14 -33.52 65.55 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.02 0.438 . . . . 0.0 109.853 179.218 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 33' ' ' TYR . . . . . 0.43 ' CB ' ' O ' ' X' ' 29' ' ' VAL . 27.2 t80 -64.98 -37.62 88.24 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.518 179.844 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 34' ' ' ALA . . . . . 0.46 ' O ' ' OD1' ' X' ' 37' ' ' ASN . . . -59.68 -40.18 86.98 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.611 -179.456 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 35' ' ' ASN . . . . . . . . . . . . . 9.6 m-80 -68.24 -38.44 81.85 Favored 'General case' 0 N--CA 1.456 -0.151 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 179.326 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 36' ' ' ASP . . . . . 0.477 ' OD1' ' N ' ' X' ' 36' ' ' ASP . 0.9 OUTLIER -67.51 -32.15 72.76 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 115.492 -0.776 . . . . 0.0 112.055 -179.866 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' X' X ' 37' ' ' ASN . . . . . 0.595 HD22 ' CG1' ' X' ' 39' ' ' VAL . 17.8 p-10 -91.78 -24.73 19.32 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 -178.431 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 38' ' ' GLY . . . . . 0.543 ' N ' ' OD1' ' X' ' 37' ' ' ASN . . . 118.55 -37.98 3.04 Favored Glycine 0 CA--C 1.534 1.278 0 C-N-CA 121.236 -0.507 . . . . 0.0 113.886 177.726 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 39' ' ' VAL . . . . . 0.595 ' CG1' HD22 ' X' ' 37' ' ' ASN . 1.5 p -80.16 108.39 13.56 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 CA-C-N 118.009 0.905 . . . . 0.0 111.442 -178.064 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 40' ' ' ASP . . . . . . . . . . . . . 22.0 t0 -127.79 111.76 14.01 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.907 179.267 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 41' ' ' GLY . . . . . 0.452 ' H ' ' CG2' ' X' ' 54' ' ' VAL . . . -141.23 -155.37 6.46 Favored Glycine 0 CA--C 1.534 1.27 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.038 -179.589 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 42' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -75.0 136.76 41.25 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-O 120.702 0.287 . . . . 0.0 110.266 -179.682 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 43' ' ' TRP . . . . . . . . . . . . . 82.4 m95 -103.23 162.01 13.33 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.898 0.856 . . . . 0.0 112.535 -178.3 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 44' ' ' THR . . . . . 0.475 ' CG2' ' OG1' ' X' ' 53' ' ' THR . 9.0 t -157.06 166.99 31.76 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 114.071 -1.422 . . . . 0.0 108.384 179.103 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 45' ' ' TYR . . . . . 0.629 ' CE1' ' CE1' ' X' ' 52' ' ' PHE . 16.8 t80 -172.46 133.78 0.65 Allowed 'General case' 0 C--N 1.332 -0.195 0 C-N-CA 119.607 -0.837 . . . . 0.0 112.079 179.943 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 46' ' ' ASP . . . . . 0.421 ' OD2' ' OG1' ' X' ' 49' ' ' THR . 7.9 t0 -123.9 112.47 17.29 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 115.125 -0.943 . . . . 0.0 108.482 177.673 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 47' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -67.69 -16.29 64.07 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-O 120.672 0.272 . . . . 0.0 111.068 -179.388 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.35 -14.81 58.73 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.141 -179.77 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 49' ' ' THR . . . . . 0.421 ' OG1' ' OD2' ' X' ' 46' ' ' ASP . 2.8 p -125.73 2.8 7.48 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 110.44 -0.208 . . . . 0.0 110.44 -179.866 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 50' ' ' LYS . . . . . . . . . . . . . 67.0 mmtt 41.61 58.46 2.74 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 120.884 -0.326 . . . . 0.0 110.551 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 51' ' ' THR . . . . . . . . . . . . . 97.4 m -147.71 126.69 12.8 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 112.132 0.419 . . . . 0.0 112.132 -179.34 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 52' ' ' PHE . . . . . 0.629 ' CE1' ' CE1' ' X' ' 45' ' ' TYR . 26.8 m-85 -107.92 155.55 20.18 Favored 'General case' 0 C--N 1.344 0.352 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 178.436 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 53' ' ' THR . . . . . 0.475 ' OG1' ' CG2' ' X' ' 44' ' ' THR . 47.0 p -151.98 129.49 11.43 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 120.401 -0.52 . . . . 0.0 110.492 179.202 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 54' ' ' VAL . . . . . 0.452 ' CG2' ' H ' ' X' ' 41' ' ' GLY . 10.7 p -113.69 123.62 69.53 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.497 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 178.964 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 55' ' ' THR . . . . . 0.534 ' HG1' ' ND2' ' X' ' 8' ' ' ASN . 4.9 t -125.46 119.89 29.46 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.299 -178.716 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 56' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 . . . . . 0 C--O 1.219 -0.507 0 CA-C-O 118.009 -0.996 . . . . 0.0 110.088 179.635 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' X' X ' 2' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 . . . . . 0 N--CA 1.464 0.263 0 CA-C-O 120.908 0.385 . . . . 0.0 110.972 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' X' X ' 3' ' ' TYR . . . . . . . . . . . . . 61.3 m-85 -122.36 137.68 54.77 Favored 'General case' 0 CA--C 1.518 -0.259 0 CA-C-N 115.835 -0.621 . . . . 0.0 109.495 179.213 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' X' X ' 4' ' ' LYS . . . . . . . . . . . . . 45.3 tttp -119.58 127.62 53.14 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 120.978 0.418 . . . . 0.0 110.721 -179.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' X' X ' 5' ' ' LEU . . . . . 0.437 ' CD1' ' C ' ' X' ' 5' ' ' LEU . 1.0 OUTLIER -108.76 127.77 54.3 Favored 'General case' 0 N--CA 1.464 0.271 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 179.077 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' X' X ' 6' ' ' ILE . . . . . 0.406 ' N ' HD21 ' X' ' 5' ' ' LEU . 29.1 mm -98.12 132.57 42.81 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.46 0 CA-C-O 121.137 0.494 . . . . 0.0 110.006 -179.207 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 7' ' ' LEU . . . . . 0.538 ' CD1' ' HG1' ' X' ' 16' ' ' THR . 6.0 mp -91.65 115.26 27.9 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.443 -178.922 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 8' ' ' ASN . . . . . . . . . . . . . 21.4 t30 -134.28 86.95 2.31 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 108.045 -1.095 . . . . 0.0 108.045 177.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' X' X ' 9' ' ' GLY . . . . . 0.447 ' H ' ' HD3' ' X' ' 13' ' ' LYS . . . -125.97 -163.36 11.53 Favored Glycine 0 C--N 1.335 0.479 0 N-CA-C 111.506 -0.638 . . . . 0.0 111.506 -178.871 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 10' ' ' LYS . . . . . . . . . . . . . 57.8 mttt -76.97 -46.98 22.15 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.973 -0.291 . . . . 0.0 111.155 -179.655 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' X' X ' 11' ' ' THR . . . . . . . . . . . . . 42.1 p -130.57 18.33 5.26 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 -179.26 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' X' X ' 12' ' ' LEU . . . . . 0.726 ' N ' ' HZ3' ' X' ' 13' ' ' LYS . 0.3 OUTLIER -138.59 100.4 4.07 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 120.87 -0.332 . . . . 0.0 111.52 -179.632 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' X' X ' 13' ' ' LYS . . . . . 0.726 ' HZ3' ' N ' ' X' ' 12' ' ' LEU . 0.0 OUTLIER -122.21 137.56 54.79 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 178.895 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' X' X ' 14' ' ' GLY . . . . . 0.435 ' O ' ' OE1' ' X' ' 15' ' ' GLU . . . 173.44 -155.16 21.8 Favored Glycine 0 CA--C 1.534 1.271 0 N-CA-C 110.923 -0.871 . . . . 0.0 110.923 -179.902 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 15' ' ' GLU . . . . . 0.435 ' OE1' ' O ' ' X' ' 14' ' ' GLY . 5.1 mm-40 -134.73 150.64 50.6 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 110.061 -0.348 . . . . 0.0 110.061 179.615 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 16' ' ' THR . . . . . 0.538 ' HG1' ' CD1' ' X' ' 7' ' ' LEU . 1.9 m -148.08 129.67 14.99 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.301 178.926 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 17' ' ' THR . . . . . . . . . . . . . 2.3 m -129.41 157.21 42.6 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 120.98 0.419 . . . . 0.0 110.608 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' X' X ' 18' ' ' THR . . . . . . . . . . . . . 7.4 t -149.26 153.31 37.38 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.85 -179.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' X' X ' 19' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -103.81 105.67 15.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.218 -0.446 . . . . 0.0 109.847 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' X' X ' 20' ' ' ALA . . . . . . . . . . . . . . . -136.28 161.97 34.3 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.635 -179.695 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' X' X ' 21' ' ' VAL . . . . . . . . . . . . . 1.1 p -87.3 -40.79 14.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.44 179.345 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' X' X ' 22' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -104.75 155.78 18.58 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.402 -179.163 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' X' X ' 23' ' ' ALA . . . . . . . . . . . . . . . -75.09 -45.94 37.93 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.943 179.772 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' X' X ' 24' ' ' ALA . . . . . . . . . . . . . . . -62.88 -40.22 96.85 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.518 -179.059 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' X' X ' 25' ' ' THR . . . . . . . . . . . . . 1.2 t -63.28 -33.06 74.68 Favored 'General case' 0 C--N 1.346 0.432 0 O-C-N 122.016 -0.428 . . . . 0.0 110.716 -179.706 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' X' X ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.1 -35.84 78.8 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.88 0.371 . . . . 0.0 110.581 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' X' X ' 27' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -62.46 -28.57 69.91 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.509 -179.733 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' X' X ' 28' ' ' LYS . . . . . 0.418 ' O ' ' OE1' ' X' ' 32' ' ' GLN . 84.0 mttt -57.51 -43.88 84.6 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.255 -0.429 . . . . 0.0 109.885 -179.012 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 29' ' ' VAL . . . . . 0.441 ' O ' ' CB ' ' X' ' 33' ' ' TYR . 13.1 t -70.03 -50.27 49.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.498 179.366 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 30' ' ' PHE . . . . . . . . . . . . . 55.9 m-85 -61.67 -43.53 98.67 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.831 -179.363 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' X' X ' 31' ' ' LYS . . . . . . . . . . . . . 72.0 mttt -69.5 -42.14 75.13 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 120.352 -0.539 . . . . 0.0 110.49 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' X' X ' 32' ' ' GLN . . . . . 0.418 ' OE1' ' O ' ' X' ' 28' ' ' LYS . 79.6 mt-30 -73.21 -33.24 65.26 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.044 0.45 . . . . 0.0 109.954 179.371 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 33' ' ' TYR . . . . . 0.524 ' CZ ' ' OD1' ' X' ' 37' ' ' ASN . 65.9 t80 -68.31 -36.97 80.13 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.704 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.23 -38.51 80.15 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.43 -179.23 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' X' X ' 35' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -60.85 -48.09 83.4 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 109.835 -0.432 . . . . 0.0 109.835 179.39 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' X' X ' 36' ' ' ASP . . . . . 0.407 ' OD1' ' N ' ' X' ' 36' ' ' ASP . 1.6 m-20 -66.87 -24.44 66.12 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.977 179.554 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 37' ' ' ASN . . . . . 0.524 ' OD1' ' CZ ' ' X' ' 33' ' ' TYR . 1.0 OUTLIER -86.62 -26.81 24.21 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.082 -178.702 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' X' X ' 38' ' ' GLY . . . . . . . . . . . . . . . 106.48 -34.98 5.34 Favored Glycine 0 CA--C 1.532 1.146 0 C-N-CA 121.343 -0.456 . . . . 0.0 112.915 178.499 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' X' X ' 39' ' ' VAL . . . . . . . . . . . . . 2.1 p -80.4 107.88 13.23 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 CA-C-N 117.728 0.764 . . . . 0.0 110.873 -178.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' X' X ' 40' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -127.8 110.83 12.99 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 115.789 -0.642 . . . . 0.0 109.964 179.551 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' X' X ' 41' ' ' GLY . . . . . 0.45 ' H ' ' CG2' ' X' ' 54' ' ' VAL . . . -141.28 -155.39 6.46 Favored Glycine 0 CA--C 1.532 1.115 0 C-N-CA 120.763 -0.732 . . . . 0.0 111.769 -179.541 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 42' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -75.08 131.14 40.34 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 120.94 0.4 . . . . 0.0 110.202 -179.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' X' X ' 43' ' ' TRP . . . . . . . . . . . . . 83.6 m95 -97.38 161.42 13.8 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.651 0.739 . . . . 0.0 112.101 -178.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' X' X ' 44' ' ' THR . . . . . 0.5 ' CG2' ' OG1' ' X' ' 53' ' ' THR . 2.5 t -157.05 167.95 28.91 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.559 -1.2 . . . . 0.0 108.786 179.33 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 45' ' ' TYR . . . . . 0.635 ' CD1' ' CE1' ' X' ' 52' ' ' PHE . 22.1 t80 -170.56 134.23 1.08 Allowed 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 119.7 -0.8 . . . . 0.0 111.856 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 46' ' ' ASP . . . . . 0.416 ' OD2' ' OG1' ' X' ' 49' ' ' THR . 11.3 t0 -123.73 112.38 17.28 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 115.145 -0.934 . . . . 0.0 108.646 177.748 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 47' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -68.45 -16.39 63.88 Favored 'General case' 0 C--O 1.231 0.096 0 CA-C-O 120.716 0.294 . . . . 0.0 110.998 -179.419 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' X' X ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.35 -13.55 59.55 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.068 -179.748 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' X' X ' 49' ' ' THR . . . . . 0.416 ' OG1' ' OD2' ' X' ' 46' ' ' ASP . 2.6 p -128.19 2.95 5.79 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 110.647 -0.131 . . . . 0.0 110.647 -179.768 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 50' ' ' LYS . . . . . . . . . . . . . 64.2 mmtt 41.87 57.47 3.14 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 120.754 -0.378 . . . . 0.0 110.442 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' X' X ' 51' ' ' THR . . . . . . . . . . . . . 94.5 m -147.26 128.3 14.58 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 112.06 0.392 . . . . 0.0 112.06 -179.309 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' X' X ' 52' ' ' PHE . . . . . 0.635 ' CE1' ' CD1' ' X' ' 45' ' ' TYR . 29.2 m-85 -107.81 154.82 20.99 Favored 'General case' 0 C--N 1.343 0.325 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 178.561 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 53' ' ' THR . . . . . 0.5 ' OG1' ' CG2' ' X' ' 44' ' ' THR . 34.2 p -151.42 129.1 11.53 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 120.531 -0.467 . . . . 0.0 110.312 179.126 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 54' ' ' VAL . . . . . 0.45 ' CG2' ' H ' ' X' ' 41' ' ' GLY . 12.5 p -113.57 123.81 69.59 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.448 0 N-CA-C 109.381 -0.599 . . . . 0.0 109.381 179.01 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 55' ' ' THR . . . . . 0.457 ' CG2' ' O ' ' X' ' 55' ' ' THR . 5.3 t -125.45 120.3 30.62 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.399 -178.469 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 56' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 . . . . . 0 C--O 1.22 -0.481 0 CA-C-O 117.971 -1.014 . . . . 0.0 110.137 179.298 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' X' X ' 2' ' ' GLN . . . . . . . . . . . . . 24.8 mt-30 . . . . . 0 N--CA 1.467 0.383 0 CA-C-O 121.278 0.561 . . . . 0.0 111.659 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' X' X ' 3' ' ' TYR . . . . . . . . . . . . . 63.2 m-85 -123.39 143.98 49.77 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-N 115.287 -0.87 . . . . 0.0 108.769 178.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' X' X ' 4' ' ' LYS . . . . . . . . . . . . . 5.1 tttm -119.43 128.65 54.22 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 121.053 0.454 . . . . 0.0 111.118 -179.117 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' X' X ' 5' ' ' LEU . . . . . 0.444 ' CD1' ' C ' ' X' ' 5' ' ' LEU . 1.0 OUTLIER -108.93 128.27 54.78 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.283 179.697 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' X' X ' 6' ' ' ILE . . . . . 0.418 ' N ' HD23 ' X' ' 5' ' ' LEU . 26.5 mm -98.88 132.73 43.62 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.439 0 CA-C-O 121.043 0.449 . . . . 0.0 110.144 -179.272 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 7' ' ' LEU . . . . . . . . . . . . . 6.3 mp -92.09 108.78 20.19 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.36 -179.088 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' X' X ' 8' ' ' ASN . . . . . . . . . . . . . 11.9 t30 -131.2 87.72 2.51 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 178.621 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' X' X ' 9' ' ' GLY . . . . . 0.709 ' H ' ' HZ2' ' X' ' 13' ' ' LYS . . . -123.04 -147.4 7.36 Favored Glycine 0 N--CA 1.464 0.533 0 N-CA-C 111.505 -0.638 . . . . 0.0 111.505 -179.139 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 10' ' ' LYS . . . . . . . . . . . . . 48.5 mttt -77.78 -51.76 10.0 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 121.054 -0.258 . . . . 0.0 111.435 -179.453 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' X' X ' 11' ' ' THR . . . . . . . . . . . . . 41.5 p -130.53 -19.4 3.05 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 112.193 0.442 . . . . 0.0 112.193 -179.408 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' X' X ' 12' ' ' LEU . . . . . 0.682 ' N ' ' HZ1' ' X' ' 13' ' ' LYS . 0.6 OUTLIER -91.37 118.63 30.69 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 120.753 0.311 . . . . 0.0 111.165 -178.803 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' X' X ' 13' ' ' LYS . . . . . 0.709 ' HZ2' ' H ' ' X' ' 9' ' ' GLY . 0.1 OUTLIER -139.26 139.97 37.55 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 120.989 0.423 . . . . 0.0 110.434 179.65 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' X' X ' 14' ' ' GLY . . . . . . . . . . . . . . . 174.45 -154.72 19.65 Favored Glycine 0 CA--C 1.534 1.27 0 N-CA-C 110.871 -0.891 . . . . 0.0 110.871 -179.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' X' X ' 15' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -134.24 151.01 51.07 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 120.677 0.275 . . . . 0.0 110.297 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 2.7 m -147.68 129.43 15.17 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.027 178.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' X' X ' 17' ' ' THR . . . . . . . . . . . . . 2.0 m -130.77 158.57 39.78 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 120.903 0.382 . . . . 0.0 110.818 -179.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' X' X ' 18' ' ' THR . . . . . . . . . . . . . 6.3 t -154.25 153.29 31.48 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.463 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' X' X ' 19' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -103.85 113.12 26.41 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 179.653 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' X' X ' 20' ' ' ALA . . . . . . . . . . . . . . . -137.34 161.09 37.22 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.018 -179.544 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' X' X ' 21' ' ' VAL . . . . . . . . . . . . . 1.1 p -80.83 -39.82 18.3 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.335 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.58 179.331 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' X' X ' 22' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -116.94 156.79 26.81 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.999 -179.432 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' X' X ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.77 -41.31 60.29 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.962 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' X' X ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.18 -36.37 83.86 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.617 -179.126 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' X' X ' 25' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -70.23 -31.77 69.34 Favored 'General case' 0 C--N 1.345 0.384 0 O-C-N 122.091 -0.381 . . . . 0.0 110.795 -179.609 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.03 -35.52 78.4 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.974 0.416 . . . . 0.0 110.703 -179.825 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' X' X ' 27' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -57.61 -29.04 64.19 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.866 -179.565 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 28' ' ' LYS . . . . . . . . . . . . . 41.0 mtmt -56.0 -42.41 76.34 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 120.391 -0.524 . . . . 0.0 110.497 -178.685 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' X' X ' 29' ' ' VAL . . . . . . . . . . . . . 12.1 t -70.12 -51.16 41.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-O 120.889 0.376 . . . . 0.0 110.505 179.283 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' X' X ' 30' ' ' PHE . . . . . . . . . . . . . 60.2 m-85 -61.97 -42.43 99.12 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.971 -179.29 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' X' X ' 31' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -63.06 -51.31 67.17 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 120.738 -0.385 . . . . 0.0 111.075 -179.305 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 32' ' ' GLN . . . . . 0.408 ' O ' ' OD1' ' X' ' 36' ' ' ASP . 79.6 mt-30 -72.09 -32.86 67.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.139 -179.489 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 33' ' ' TYR . . . . . . . . . . . . . 29.1 t80 -60.9 -34.79 75.21 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.873 -179.406 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' X' X ' 34' ' ' ALA . . . . . 0.454 ' O ' ' OD1' ' X' ' 37' ' ' ASN . . . -59.9 -43.55 94.76 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.33 -179.414 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 35' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -66.84 -36.22 81.83 Favored 'General case' 0 N--CA 1.447 -0.621 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 179.4 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 36' ' ' ASP . . . . . 0.494 ' OD1' ' N ' ' X' ' 36' ' ' ASP . 0.7 OUTLIER -67.38 -31.05 71.02 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.893 -179.857 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' X' X ' 37' ' ' ASN . . . . . 0.583 HD22 ' CG1' ' X' ' 39' ' ' VAL . 15.8 p-10 -95.57 -24.58 16.54 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 111.951 0.352 . . . . 0.0 111.951 -178.528 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 38' ' ' GLY . . . . . 0.533 ' N ' ' OD1' ' X' ' 37' ' ' ASN . . . 121.24 -41.06 1.97 Allowed Glycine 0 CA--C 1.532 1.155 0 C-N-CA 121.308 -0.472 . . . . 0.0 113.514 177.957 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 39' ' ' VAL . . . . . 0.583 ' CG1' HD22 ' X' ' 37' ' ' ASN . 1.5 p -80.19 108.57 13.77 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.325 0 CA-C-N 117.735 0.767 . . . . 0.0 111.597 -178.149 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 40' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -127.74 111.54 13.79 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.881 179.084 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' X' X ' 41' ' ' GLY . . . . . 0.447 ' H ' ' CG2' ' X' ' 54' ' ' VAL . . . -141.48 -156.07 6.69 Favored Glycine 0 CA--C 1.534 1.232 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.077 -179.501 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 42' ' ' GLU . . . . . 0.531 ' CD ' ' H ' ' X' ' 42' ' ' GLU . 2.5 mp0 -75.14 139.12 42.5 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-O 120.743 0.306 . . . . 0.0 110.251 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 43' ' ' TRP . . . . . . . . . . . . . 81.3 m95 -103.86 163.47 12.33 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.866 0.841 . . . . 0.0 112.679 -178.262 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' X' X ' 44' ' ' THR . . . . . 0.48 ' CG2' ' OG1' ' X' ' 53' ' ' THR . 10.4 t -156.98 167.07 31.57 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 114.125 -1.398 . . . . 0.0 108.341 178.955 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 45' ' ' TYR . . . . . 0.623 ' CD1' ' CZ ' ' X' ' 52' ' ' PHE . 27.5 t80 -171.72 135.44 0.87 Allowed 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 119.603 -0.839 . . . . 0.0 111.858 -179.935 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 46' ' ' ASP . . . . . . . . . . . . . 11.7 t0 -123.29 112.44 17.63 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 177.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' X' X ' 47' ' ' ASP . . . . . . . . . . . . . 49.2 t0 -64.6 -15.67 61.5 Favored 'General case' 0 C--N 1.334 -0.076 0 CA-C-N 116.661 -0.245 . . . . 0.0 111.518 -179.143 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' X' X ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.99 -36.15 36.42 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 120.872 -0.331 . . . . 0.0 111.538 -179.494 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' X' X ' 49' ' ' THR . . . . . . . . . . . . . 2.8 p -102.84 2.91 36.04 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 110.632 -0.136 . . . . 0.0 110.632 -179.534 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' X' X ' 50' ' ' LYS . . . . . . . . . . . . . 14.0 mmmt 41.89 56.53 3.43 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 120.68 0.276 . . . . 0.0 110.412 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' X' X ' 51' ' ' THR . . . . . . . . . . . . . 39.0 m -144.32 129.49 18.67 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 -179.241 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' X' X ' 52' ' ' PHE . . . . . 0.623 ' CZ ' ' CD1' ' X' ' 45' ' ' TYR . 53.1 m-85 -108.31 153.77 22.76 Favored 'General case' 0 C--N 1.344 0.342 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 178.524 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 53' ' ' THR . . . . . 0.48 ' OG1' ' CG2' ' X' ' 44' ' ' THR . 65.9 p -151.23 130.12 12.47 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 120.522 -0.471 . . . . 0.0 110.476 179.185 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 54' ' ' VAL . . . . . 0.447 ' CG2' ' H ' ' X' ' 41' ' ' GLY . 11.2 p -113.53 123.98 69.72 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 179.21 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 55' ' ' THR . . . . . 0.448 ' CG2' ' O ' ' X' ' 55' ' ' THR . 4.2 t -125.34 120.68 31.81 Favored 'General case' 0 N--CA 1.474 0.725 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.351 -178.719 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 56' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 . . . . . 0 C--O 1.22 -0.463 0 CA-C-O 117.983 -1.008 . . . . 0.0 110.027 179.607 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' X' X ' 1' ' ' MET . . . . . 0.589 ' SD ' ' CZ ' ' X' ' 3' ' ' TYR . 0.1 OUTLIER . . . . . 0 N--CA 1.493 1.685 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 2' ' ' GLN . . . . . . . . . . . . . 29.7 mt-30 -125.6 147.96 49.12 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 121.162 0.506 . . . . 0.0 111.072 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 3' ' ' TYR . . . . . 0.589 ' CZ ' ' SD ' ' X' ' 1' ' ' MET . 72.8 m-85 -115.66 143.1 45.84 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.447 179.341 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 4' ' ' LYS . . . . . . . . . . . . . 45.7 tttp -119.6 127.14 52.67 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 120.964 0.412 . . . . 0.0 110.331 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 5' ' ' LEU . . . . . 0.437 ' CD1' ' C ' ' X' ' 5' ' ' LEU . 1.0 OUTLIER -107.59 127.11 53.35 Favored 'General case' 0 N--CA 1.465 0.276 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 179.471 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' X' X ' 6' ' ' ILE . . . . . 0.41 ' N ' HD23 ' X' ' 5' ' ' LEU . 27.2 mm -98.43 132.91 42.59 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.493 0 CA-C-O 121.231 0.539 . . . . 0.0 109.78 -179.365 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 7' ' ' LEU . . . . . . . . . . . . . 6.0 mp -91.83 107.72 19.41 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.848 -178.617 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 8' ' ' ASN . . . . . 0.492 ' ND2' ' O ' ' X' ' 54' ' ' VAL . 1.7 p-10 -125.76 85.85 2.45 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 107.045 -1.465 . . . . 0.0 107.045 176.914 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 9' ' ' GLY . . . . . 0.704 ' N ' ' HZ1' ' X' ' 13' ' ' LYS . . . -116.06 -162.67 13.26 Favored Glycine 0 C--N 1.334 0.439 0 N-CA-C 111.271 -0.732 . . . . 0.0 111.271 -178.785 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 10' ' ' LYS . . . . . . . . . . . . . 48.1 mttt -66.67 -54.5 22.47 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 120.523 -0.471 . . . . 0.0 110.753 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 11' ' ' THR . . . . . . . . . . . . . 42.6 p -130.88 -8.78 3.94 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 120.692 0.282 . . . . 0.0 111.208 179.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 12' ' ' LEU . . . . . 0.495 ' C ' ' HZ3' ' X' ' 13' ' ' LYS . 0.6 OUTLIER -95.93 114.69 26.44 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.107 -178.713 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' X' X ' 13' ' ' LYS . . . . . 0.704 ' HZ1' ' N ' ' X' ' 9' ' ' GLY . 0.3 OUTLIER -135.54 142.56 45.4 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-O 120.942 0.401 . . . . 0.0 110.723 179.66 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' X' X ' 14' ' ' GLY . . . . . 0.432 ' O ' ' OE1' ' X' ' 15' ' ' GLU . . . 174.27 -158.03 26.22 Favored Glycine 0 CA--C 1.533 1.205 0 N-CA-C 110.937 -0.865 . . . . 0.0 110.937 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 15' ' ' GLU . . . . . 0.432 ' OE1' ' O ' ' X' ' 14' ' ' GLY . 5.0 mm-40 -134.17 150.88 51.12 Favored 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 110.139 -0.319 . . . . 0.0 110.139 179.689 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 2.3 m -148.02 129.43 14.83 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.278 178.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 17' ' ' THR . . . . . . . . . . . . . 2.4 m -131.44 157.36 43.67 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 120.878 0.37 . . . . 0.0 110.546 179.835 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 18' ' ' THR . . . . . . . . . . . . . 7.5 t -149.52 152.96 36.44 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.019 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 19' ' ' GLU . . . . . 0.422 ' OE2' ' O ' ' X' ' 1' ' ' MET . 0.0 OUTLIER -103.93 105.81 16.12 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 179.924 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' X' X ' 20' ' ' ALA . . . . . . . . . . . . . . . -131.56 161.61 32.24 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 121.16 0.505 . . . . 0.0 111.235 -179.189 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 21' ' ' VAL . . . . . . . . . . . . . 1.2 p -87.02 -37.4 11.14 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.222 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.48 179.314 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 22' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -111.33 156.0 22.22 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.927 -179.416 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.99 -46.16 37.12 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.03 179.806 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 24' ' ' ALA . . . . . . . . . . . . . . . -62.41 -39.75 94.28 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.473 -179.011 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 25' ' ' THR . . . . . . . . . . . . . 1.1 t -64.14 -31.95 73.33 Favored 'General case' 0 C--N 1.345 0.393 0 C-N-CA 120.73 -0.388 . . . . 0.0 110.622 -179.609 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.03 -35.87 78.98 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.901 0.381 . . . . 0.0 110.651 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 27' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -61.76 -28.38 69.4 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.567 -179.775 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 28' ' ' LYS . . . . . . . . . . . . . 83.4 mttt -56.93 -43.1 81.12 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.178 -178.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 29' ' ' VAL . . . . . 0.427 ' O ' ' CB ' ' X' ' 33' ' ' TYR . 13.8 t -69.99 -51.19 42.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.533 179.298 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 30' ' ' PHE . . . . . . . . . . . . . 61.0 m-85 -61.91 -43.18 99.38 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.873 -179.301 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 31' ' ' LYS . . . . . . . . . . . . . 2.7 tppt? -66.34 -47.74 72.5 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 120.534 -0.466 . . . . 0.0 110.52 -179.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 32' ' ' GLN . . . . . . . . . . . . . 57.8 tp60 -71.81 -33.72 68.76 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.657 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 33' ' ' TYR . . . . . 0.427 ' CB ' ' O ' ' X' ' 29' ' ' VAL . 19.1 t80 -61.38 -30.52 70.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.478 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 34' ' ' ALA . . . . . 0.44 ' O ' ' OD1' ' X' ' 37' ' ' ASN . . . -59.32 -39.29 82.61 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.638 -178.6 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 35' ' ' ASN . . . . . . . . . . . . . 39.3 t-20 -69.06 -34.84 75.81 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 120.505 -0.478 . . . . 0.0 109.759 179.446 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 36' ' ' ASP . . . . . 0.508 ' OD1' ' N ' ' X' ' 36' ' ' ASP . 0.7 OUTLIER -67.28 -35.3 79.21 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 115.709 -0.678 . . . . 0.0 112.104 -179.538 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' X' X ' 37' ' ' ASN . . . . . 0.519 ' OD1' ' N ' ' X' ' 38' ' ' GLY . 24.6 p-10 -95.37 -25.17 16.39 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 120.86 -0.336 . . . . 0.0 111.512 -178.877 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 38' ' ' GLY . . . . . 0.519 ' N ' ' OD1' ' X' ' 37' ' ' ASN . . . 103.17 28.57 6.07 Favored Glycine 0 CA--C 1.534 1.238 0 CA-C-O 119.473 -0.626 . . . . 0.0 114.172 177.165 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 39' ' ' VAL . . . . . 0.472 ' CG2' ' O ' ' X' ' 39' ' ' VAL . 2.4 m -122.77 113.33 37.75 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 CA-C-N 118.201 1.001 . . . . 0.0 110.569 178.749 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 40' ' ' ASP . . . . . . . . . . . . . 19.0 t0 -127.35 108.01 10.48 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 179.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -145.19 -165.68 11.34 Favored Glycine 0 CA--C 1.531 1.065 0 N-CA-C 111.485 -0.646 . . . . 0.0 111.485 179.8 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 42' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -75.61 125.14 28.45 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 121.023 0.439 . . . . 0.0 110.429 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 43' ' ' TRP . . . . . . . . . . . . . 79.2 m95 -91.79 161.45 14.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.543 0.687 . . . . 0.0 111.59 -179.46 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 44' ' ' THR . . . . . 0.472 ' CG2' ' OG1' ' X' ' 53' ' ' THR . 9.1 t -156.91 167.57 30.08 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 114.617 -1.174 . . . . 0.0 108.497 179.162 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 45' ' ' TYR . . . . . 0.636 ' CD1' ' CE1' ' X' ' 52' ' ' PHE . 14.7 t80 -171.08 133.61 0.89 Allowed 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 119.458 -0.897 . . . . 0.0 112.062 -179.787 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 46' ' ' ASP . . . . . . . . . . . . . 12.7 t0 -123.95 112.39 17.15 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 177.627 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 47' ' ' ASP . . . . . 0.408 ' OD1' ' O ' ' X' ' 47' ' ' ASP . 10.1 t70 -67.19 -16.74 64.49 Favored 'General case' 0 C--O 1.231 0.106 0 CA-C-O 120.656 0.265 . . . . 0.0 110.997 -179.413 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.31 -12.97 59.93 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.138 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 49' ' ' THR . . . . . . . . . . . . . 2.6 p -128.16 2.93 5.81 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 110.526 -0.175 . . . . 0.0 110.526 -179.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 50' ' ' LYS . . . . . . . . . . . . . 68.5 mmtt 41.57 58.62 2.68 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 120.827 -0.349 . . . . 0.0 110.571 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 51' ' ' THR . . . . . . . . . . . . . 91.1 m -148.47 127.55 12.82 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 112.302 0.482 . . . . 0.0 112.302 -179.282 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 52' ' ' PHE . . . . . 0.636 ' CE1' ' CD1' ' X' ' 45' ' ' TYR . 19.4 m-85 -107.9 155.38 20.35 Favored 'General case' 0 C--N 1.344 0.357 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 178.318 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 53' ' ' THR . . . . . 0.472 ' OG1' ' CG2' ' X' ' 44' ' ' THR . 68.6 p -152.48 130.04 11.48 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 120.454 -0.498 . . . . 0.0 110.682 179.464 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 54' ' ' VAL . . . . . 0.492 ' O ' ' ND2' ' X' ' 8' ' ' ASN . 11.5 p -113.81 123.74 69.77 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 178.72 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 55' ' ' THR . . . . . . . . . . . . . 5.0 t -121.74 125.02 45.6 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.319 -178.412 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 56' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 . . . . . 0 C--O 1.22 -0.484 0 CA-C-O 117.955 -1.022 . . . . 0.0 110.348 179.765 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' X' X ' 1' ' ' MET . . . . . 0.59 ' SD ' ' NZ ' ' X' ' 50' ' ' LYS . 0.1 OUTLIER . . . . . 0 N--CA 1.493 1.717 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 . . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 2' ' ' GLN . . . . . . . . . . . . . 86.5 mt-30 -126.94 146.7 50.22 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 121.006 0.431 . . . . 0.0 110.936 -179.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 3' ' ' TYR . . . . . 0.48 ' OH ' ' CE ' ' X' ' 1' ' ' MET . 60.6 m-85 -124.67 137.84 54.34 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.555 179.283 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 4' ' ' LYS . . . . . . . . . . . . . 10.0 ttmm -119.62 127.35 52.85 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 120.935 0.398 . . . . 0.0 110.303 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 5' ' ' LEU . . . . . 0.44 ' CD1' ' C ' ' X' ' 5' ' ' LEU . 1.0 OUTLIER -108.95 128.17 54.7 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 179.458 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' X' X ' 6' ' ' ILE . . . . . 0.424 ' N ' HD22 ' X' ' 5' ' ' LEU . 28.1 mm -98.45 132.12 44.2 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.485 0 CA-C-O 120.958 0.409 . . . . 0.0 109.954 -179.385 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 7' ' ' LEU . . . . . . . . . . . . . 6.2 mp -92.16 112.54 24.51 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.246 -179.221 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 8' ' ' ASN . . . . . 0.498 ' ND2' ' O ' ' X' ' 54' ' ' VAL . 2.9 p-10 -132.58 87.51 2.42 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.199 -1.038 . . . . 0.0 108.199 178.214 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 9' ' ' GLY . . . . . 0.52 ' C ' ' HZ2' ' X' ' 13' ' ' LYS . . . -122.85 -158.01 10.09 Favored Glycine 0 C--N 1.335 0.523 0 N-CA-C 111.201 -0.759 . . . . 0.0 111.201 -178.905 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 10' ' ' LYS . . . . . . . . . . . . . 70.2 mttt -73.64 -47.42 40.19 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.785 -0.366 . . . . 0.0 111.239 -179.534 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 11' ' ' THR . . . . . . . . . . . . . 41.6 p -130.62 -15.8 3.47 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 -179.384 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 12' ' ' LEU . . . . . 0.482 ' N ' ' HZ3' ' X' ' 13' ' ' LYS . 0.4 OUTLIER -99.36 112.96 25.04 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 120.762 0.315 . . . . 0.0 111.449 -178.672 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' X' X ' 13' ' ' LYS . . . . . 0.52 ' HZ2' ' C ' ' X' ' 9' ' ' GLY . 0.3 OUTLIER -135.01 139.2 44.66 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.103 179.265 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' X' X ' 14' ' ' GLY . . . . . . . . . . . . . . . 174.38 -154.75 19.82 Favored Glycine 0 CA--C 1.535 1.305 0 N-CA-C 110.861 -0.896 . . . . 0.0 110.861 -179.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 15' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -133.39 150.29 51.8 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 120.731 0.3 . . . . 0.0 110.446 179.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 2.8 m -148.06 129.42 14.78 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.328 178.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 17' ' ' THR . . . . . . . . . . . . . 2.4 m -130.28 156.86 43.95 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 120.961 0.41 . . . . 0.0 110.728 179.794 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 18' ' ' THR . . . . . . . . . . . . . 7.5 t -148.97 153.3 37.74 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.86 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 19' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -103.93 105.63 15.88 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.217 -0.447 . . . . 0.0 109.88 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 20' ' ' ALA . . . . . . . . . . . . . . . -136.71 163.46 30.55 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.741 -179.639 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 21' ' ' VAL . . . . . . . . . . . . . 1.1 p -89.81 -40.7 13.2 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.279 0 CA-C-N 115.883 -0.599 . . . . 0.0 109.389 179.291 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 22' ' ' ASP . . . . . . . . . . . . . 37.1 m-20 -103.69 155.11 18.83 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.413 -179.157 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 23' ' ' ALA . . . . . . . . . . . . . . . -75.16 -45.97 37.29 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.925 179.657 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.81 -39.87 95.26 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.454 -179.049 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 25' ' ' THR . . . . . . . . . . . . . 1.2 t -63.55 -34.06 76.96 Favored 'General case' 0 C--N 1.346 0.423 0 C-N-CA 120.617 -0.433 . . . . 0.0 110.607 -179.53 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.25 -35.86 78.57 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.945 0.403 . . . . 0.0 110.568 179.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 27' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -60.02 -29.32 68.42 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.812 -179.493 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 28' ' ' LYS . . . . . . . . . . . . . 41.2 mtmt -56.03 -41.97 75.8 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 120.416 -0.513 . . . . 0.0 110.416 -178.7 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 29' ' ' VAL . . . . . 0.428 ' O ' ' CB ' ' X' ' 33' ' ' TYR . 11.5 t -70.26 -51.71 36.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-O 120.984 0.421 . . . . 0.0 110.526 179.337 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 30' ' ' PHE . . . . . . . . . . . . . 57.6 m-85 -61.96 -42.9 99.64 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.986 -179.188 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 31' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -61.66 -51.25 69.22 Favored 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 120.494 -0.482 . . . . 0.0 110.73 -179.47 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 32' ' ' GLN . . . . . . . . . . . . . 45.0 tt0 -73.48 -35.93 65.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.285 -179.606 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 33' ' ' TYR . . . . . 0.428 ' CB ' ' O ' ' X' ' 29' ' ' VAL . 70.0 t80 -61.8 -46.1 91.0 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.552 -0.294 . . . . 0.0 111.09 -179.388 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.16 -41.37 88.21 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.609 -0.437 . . . . 0.0 110.049 -179.287 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 35' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -60.46 -43.5 96.84 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 178.701 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 36' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -66.99 -26.48 66.82 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.342 179.048 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 37' ' ' ASN . . . . . 0.415 ' ND2' ' CE2' ' X' ' 33' ' ' TYR . 1.5 t-20 -83.77 -25.89 30.1 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.867 -178.96 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 38' ' ' GLY . . . . . . . . . . . . . . . 114.8 -37.52 3.49 Favored Glycine 0 CA--C 1.531 1.038 0 C-N-CA 121.559 -0.353 . . . . 0.0 112.285 178.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 39' ' ' VAL . . . . . . . . . . . . . 1.4 p -80.55 108.75 14.26 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.305 0 CA-C-N 117.333 0.567 . . . . 0.0 111.107 -179.123 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 40' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -127.28 110.89 13.3 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 115.846 -0.616 . . . . 0.0 109.816 179.325 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 41' ' ' GLY . . . . . 0.419 ' H ' ' CG2' ' X' ' 54' ' ' VAL . . . -141.37 -157.36 7.14 Favored Glycine 0 CA--C 1.533 1.174 0 C-N-CA 120.764 -0.731 . . . . 0.0 111.927 -179.485 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 42' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -75.12 133.05 41.61 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 120.877 0.37 . . . . 0.0 110.254 -179.777 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 43' ' ' TRP . . . . . . . . . . . . . 82.0 m95 -98.02 161.5 13.69 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.734 0.778 . . . . 0.0 112.078 -178.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 44' ' ' THR . . . . . 0.499 ' CG2' ' OG1' ' X' ' 53' ' ' THR . 2.5 t -157.07 169.1 25.58 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 114.348 -1.297 . . . . 0.0 108.818 179.381 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 45' ' ' TYR . . . . . 0.627 ' CD1' ' CE1' ' X' ' 52' ' ' PHE . 7.0 t80 -173.38 135.14 0.54 Allowed 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 119.801 -0.76 . . . . 0.0 111.7 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 46' ' ' ASP . . . . . 0.401 ' N ' ' CD1' ' X' ' 45' ' ' TYR . 8.5 t0 -123.56 112.42 17.43 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 115.269 -0.878 . . . . 0.0 108.648 177.955 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 47' ' ' ASP . . . . . 0.447 ' CG ' ' HZ1' ' X' ' 50' ' ' LYS . 11.7 t70 -66.51 -14.65 62.57 Favored 'General case' 0 C--N 1.334 -0.101 0 CA-C-O 120.825 0.345 . . . . 0.0 110.714 -179.547 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.82 -13.19 59.59 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.149 -179.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 49' ' ' THR . . . . . . . . . . . . . 3.0 p -129.03 4.29 5.31 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 112.138 0.421 . . . . 0.0 112.138 -178.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 50' ' ' LYS . . . . . 0.59 ' NZ ' ' SD ' ' X' ' 1' ' ' MET . 11.3 mmpt? 44.9 56.0 5.65 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 119.76 -0.776 . . . . 0.0 110.654 -179.694 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 51' ' ' THR . . . . . . . . . . . . . 36.6 m -149.91 130.0 13.55 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 112.519 0.563 . . . . 0.0 112.519 -179.015 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 52' ' ' PHE . . . . . 0.627 ' CE1' ' CD1' ' X' ' 45' ' ' TYR . 14.0 m-85 -110.89 154.3 24.25 Favored 'General case' 0 C--N 1.346 0.442 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 178.236 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 53' ' ' THR . . . . . 0.499 ' OG1' ' CG2' ' X' ' 44' ' ' THR . 47.5 p -150.95 131.14 13.54 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 120.333 -0.547 . . . . 0.0 110.472 179.151 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 54' ' ' VAL . . . . . 0.498 ' O ' ' ND2' ' X' ' 8' ' ' ASN . 10.8 p -113.48 124.31 69.99 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 179.176 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 55' ' ' THR . . . . . 0.453 ' O ' ' CG2' ' X' ' 55' ' ' THR . 4.7 t -124.82 120.99 33.28 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 116.4 -0.363 . . . . 0.0 111.445 -178.594 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 56' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 . . . . . 0 C--O 1.22 -0.459 0 CA-C-O 117.917 -1.04 . . . . 0.0 110.208 179.389 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' X' X ' 1' ' ' MET . . . . . 0.61 ' SD ' ' NZ ' ' X' ' 50' ' ' LYS . 0.2 OUTLIER . . . . . 0 N--CA 1.494 1.761 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 2' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 -127.7 138.34 52.76 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 120.998 0.427 . . . . 0.0 111.177 -179.491 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 3' ' ' TYR . . . . . 0.473 ' OH ' ' SD ' ' X' ' 1' ' ' MET . 64.5 m-85 -115.99 141.22 48.41 Favored 'General case' 0 CA--C 1.517 -0.308 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 178.733 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 4' ' ' LYS . . . . . . . . . . . . . 49.8 tttp -119.47 127.28 52.92 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 120.767 0.317 . . . . 0.0 110.34 -179.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 5' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -103.32 130.01 50.49 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.109 179.809 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 6' ' ' ILE . . . . . . . . . . . . . 32.6 mm -101.17 127.3 54.55 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.485 0 N-CA-C 109.349 -0.612 . . . . 0.0 109.349 178.07 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 7' ' ' LEU . . . . . . . . . . . . . 6.3 mp -93.45 112.11 23.93 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.502 -178.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 8' ' ' ASN . . . . . 0.558 ' N ' ' OD1' ' X' ' 8' ' ' ASN . 1.9 p-10 -134.59 87.61 2.37 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 178.237 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 9' ' ' GLY . . . . . 0.512 ' H ' ' NZ ' ' X' ' 13' ' ' LYS . . . -125.76 -157.4 9.6 Favored Glycine 0 C--N 1.336 0.543 0 N-CA-C 111.404 -0.678 . . . . 0.0 111.404 -178.971 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 10' ' ' LYS . . . . . . . . . . . . . 70.8 mttt -79.97 -49.18 12.21 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 121.059 -0.256 . . . . 0.0 111.543 -179.248 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 11' ' ' THR . . . . . . . . . . . . . 42.5 p -130.2 18.46 5.44 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -179.031 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 12' ' ' LEU . . . . . 0.74 ' H ' ' HZ3' ' X' ' 13' ' ' LYS . 0.4 OUTLIER -138.41 106.34 5.68 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 120.803 0.335 . . . . 0.0 110.905 -179.699 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' X' X ' 13' ' ' LYS . . . . . 0.74 ' HZ3' ' H ' ' X' ' 12' ' ' LEU . 0.2 OUTLIER -130.78 138.94 50.16 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.273 179.509 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' X' X ' 14' ' ' GLY . . . . . 0.427 ' O ' ' OE2' ' X' ' 15' ' ' GLU . . . 173.87 -155.4 21.79 Favored Glycine 0 CA--C 1.533 1.183 0 N-CA-C 111.158 -0.777 . . . . 0.0 111.158 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 15' ' ' GLU . . . . . 0.427 ' OE2' ' O ' ' X' ' 14' ' ' GLY . 6.6 mm-40 -134.11 151.98 51.63 Favored 'General case' 0 N--CA 1.465 0.291 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 179.609 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -147.75 141.67 25.85 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 179.142 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 17' ' ' THR . . . . . . . . . . . . . 2.6 m -144.4 154.55 43.1 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 121.19 0.519 . . . . 0.0 110.978 179.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 18' ' ' THR . . . . . 0.412 ' CG2' ' CZ ' ' X' ' 30' ' ' PHE . 14.6 t -155.45 153.58 30.55 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.411 -179.845 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 19' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -103.65 105.61 15.89 Favored 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 179.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 20' ' ' ALA . . . . . . . . . . . . . . . -126.98 160.45 31.03 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.798 -179.678 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 21' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -80.77 -41.4 19.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 N-CA-C 109.29 -0.634 . . . . 0.0 109.29 179.277 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 22' ' ' ASP . . . . . 0.445 ' N ' ' OD1' ' X' ' 22' ' ' ASP . 32.1 p-10 -127.99 161.47 29.08 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.573 -179.774 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.2 -35.19 63.93 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.028 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.63 -37.65 76.37 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.91 -178.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 25' ' ' THR . . . . . 0.402 ' CG2' ' OD1' ' X' ' 22' ' ' ASP . 1.5 t -75.23 -40.19 59.25 Favored 'General case' 0 C--N 1.345 0.376 0 CA-C-N 118.129 0.422 . . . . 0.0 111.239 -179.337 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.93 -35.58 78.67 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.849 0.356 . . . . 0.0 111.162 -179.448 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 27' ' ' GLU . . . . . 0.435 ' O ' ' CB ' ' X' ' 31' ' ' LYS . 1.6 pt-20 -59.59 -30.46 68.69 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.237 -179.235 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 28' ' ' LYS . . . . . . . . . . . . . 81.7 mttt -58.07 -48.83 78.93 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.307 -0.557 . . . . 0.0 110.326 -178.425 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 29' ' ' VAL . . . . . 0.43 ' O ' ' CB ' ' X' ' 33' ' ' TYR . 12.4 t -72.55 -51.72 27.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-O 121.189 0.518 . . . . 0.0 110.795 179.24 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 30' ' ' PHE . . . . . 0.412 ' CZ ' ' CG2' ' X' ' 18' ' ' THR . 4.6 m-30 -61.48 -43.18 99.33 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.828 -178.672 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 31' ' ' LYS . . . . . 0.435 ' CB ' ' O ' ' X' ' 27' ' ' GLU . 14.9 ttmt -66.65 -46.98 73.99 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.218 -0.593 . . . . 0.0 110.575 -179.892 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 32' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -73.49 -32.86 64.51 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.118 -179.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 33' ' ' TYR . . . . . 0.43 ' CB ' ' O ' ' X' ' 29' ' ' VAL . 58.1 t80 -60.66 -46.09 91.63 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.141 -178.922 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 34' ' ' ALA . . . . . 0.482 ' O ' ' OD1' ' X' ' 37' ' ' ASN . . . -60.17 -36.42 77.55 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.649 -0.421 . . . . 0.0 110.171 -179.733 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 35' ' ' ASN . . . . . . . . . . . . . 5.7 t30 -71.18 -44.49 65.35 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 179.416 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 36' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -67.39 -32.77 73.9 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.827 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 37' ' ' ASN . . . . . 0.563 ' OD1' ' N ' ' X' ' 38' ' ' GLY . 24.5 p30 -79.23 -24.3 43.16 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 120.474 -0.49 . . . . 0.0 111.328 -178.832 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 38' ' ' GLY . . . . . 0.563 ' N ' ' OD1' ' X' ' 37' ' ' ASN . . . 130.87 -44.41 1.21 Allowed Glycine 0 CA--C 1.532 1.134 0 C-N-CA 121.257 -0.497 . . . . 0.0 112.738 178.601 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 39' ' ' VAL . . . . . . . . . . . . . 1.9 p -81.0 109.08 14.98 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 CA-C-N 117.403 0.601 . . . . 0.0 112.089 -178.114 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 40' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -128.19 111.02 12.98 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.49 178.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -143.52 -155.24 6.36 Favored Glycine 0 CA--C 1.533 1.202 0 C-N-CA 120.291 -0.957 . . . . 0.0 112.471 -179.298 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 42' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -74.37 141.64 45.13 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 -179.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 43' ' ' TRP . . . . . . . . . . . . . 83.6 m95 -104.99 162.37 13.41 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.897 0.856 . . . . 0.0 112.858 -177.829 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 44' ' ' THR . . . . . 0.498 ' CG2' ' OG1' ' X' ' 53' ' ' THR . 2.5 t -157.01 164.21 38.24 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 114.073 -1.421 . . . . 0.0 108.828 179.339 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 45' ' ' TYR . . . . . 0.62 ' CD1' ' CE1' ' X' ' 52' ' ' PHE . 3.0 t80 -175.03 134.53 0.34 Allowed 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 119.701 -0.8 . . . . 0.0 111.666 179.862 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 46' ' ' ASP . . . . . 0.514 ' N ' ' CD1' ' X' ' 45' ' ' TYR . 11.2 t0 -123.74 112.56 17.49 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 115.186 -0.916 . . . . 0.0 108.699 177.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 47' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -65.81 -15.63 63.06 Favored 'General case' 0 C--O 1.231 0.079 0 CA-C-O 120.698 0.285 . . . . 0.0 110.918 -179.674 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.33 -13.67 59.49 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.069 -179.729 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 49' ' ' THR . . . . . . . . . . . . . 2.7 p -128.29 3.14 5.73 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 121.436 -0.106 . . . . 0.0 110.725 -179.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 50' ' ' LYS . . . . . 0.61 ' NZ ' ' SD ' ' X' ' 1' ' ' MET . 68.6 mmtt 41.18 56.39 3.07 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 120.839 -0.344 . . . . 0.0 110.632 -179.938 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 51' ' ' THR . . . . . . . . . . . . . 96.8 m -144.16 127.02 16.29 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 120.671 0.272 . . . . 0.0 111.456 -179.409 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 52' ' ' PHE . . . . . 0.62 ' CE1' ' CD1' ' X' ' 45' ' ' TYR . 15.9 m-85 -109.44 153.93 23.34 Favored 'General case' 0 C--N 1.343 0.295 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 179.109 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 53' ' ' THR . . . . . 0.498 ' OG1' ' CG2' ' X' ' 44' ' ' THR . 4.3 p -152.23 129.3 11.09 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 120.493 -0.483 . . . . 0.0 109.989 178.82 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 54' ' ' VAL . . . . . 0.425 ' O ' ' OD1' ' X' ' 8' ' ' ASN . 14.4 p -112.84 124.2 69.25 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 178.48 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 55' ' ' THR . . . . . 0.42 ' O ' ' CG2' ' X' ' 55' ' ' THR . 2.0 t -124.55 124.49 42.38 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.651 -178.085 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 56' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 . . . . . 0 C--O 1.221 -0.402 0 CA-C-O 117.968 -1.015 . . . . 0.0 110.09 179.465 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' X' X ' 1' ' ' MET . . . . . 0.592 ' SD ' ' NZ ' ' X' ' 50' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.706 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 . . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 2' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -127.91 142.27 51.31 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.879 0.371 . . . . 0.0 110.756 -179.827 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 3' ' ' TYR . . . . . 0.471 ' OH ' ' CE ' ' X' ' 1' ' ' MET . 92.0 m-85 -115.81 148.44 39.89 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.9 -0.591 . . . . 0.0 109.627 179.379 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 4' ' ' LYS . . . . . . . . . . . . . 45.5 tttp -119.27 127.81 53.58 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 120.927 0.394 . . . . 0.0 110.259 179.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 5' ' ' LEU . . . . . 0.444 ' CD1' ' C ' ' X' ' 5' ' ' LEU . 1.1 tm? -109.72 127.83 54.86 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.403 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 6' ' ' ILE . . . . . 0.402 ' N ' HD23 ' X' ' 5' ' ' LEU . 26.8 mm -98.91 132.34 44.41 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.349 0 CA-C-O 120.901 0.381 . . . . 0.0 110.15 -179.361 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 7' ' ' LEU . . . . . . . . . . . . . 6.3 mp -92.42 110.75 22.16 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.649 -179.131 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 8' ' ' ASN . . . . . 0.469 ' N ' ' OD1' ' X' ' 8' ' ' ASN . 6.3 p-10 -134.57 87.68 2.37 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 178.034 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 9' ' ' GLY . . . . . 0.751 ' H ' ' HZ3' ' X' ' 13' ' ' LYS . . . -123.89 -143.5 6.26 Favored Glycine 0 N--CA 1.464 0.552 0 N-CA-C 111.662 -0.575 . . . . 0.0 111.662 -179.158 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 10' ' ' LYS . . . . . . . . . . . . . 74.1 mttt -87.98 -53.17 4.87 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 111.818 0.303 . . . . 0.0 111.818 -179.274 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 11' ' ' THR . . . . . . . . . . . . . 41.4 p -130.29 21.83 5.23 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 -178.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 12' ' ' LEU . . . . . 0.711 ' N ' ' HZ2' ' X' ' 13' ' ' LYS . 0.6 OUTLIER -138.56 116.98 12.0 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 120.707 0.289 . . . . 0.0 110.725 -179.95 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' X' X ' 13' ' ' LYS . . . . . 0.751 ' HZ3' ' H ' ' X' ' 9' ' ' GLY . 0.3 OUTLIER -138.88 139.72 38.17 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.009 0.433 . . . . 0.0 110.749 179.889 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' X' X ' 14' ' ' GLY . . . . . 0.439 ' O ' ' OE1' ' X' ' 15' ' ' GLU . . . 174.17 -155.24 21.15 Favored Glycine 0 CA--C 1.533 1.17 0 N-CA-C 110.624 -0.991 . . . . 0.0 110.624 -179.913 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 15' ' ' GLU . . . . . 0.439 ' OE1' ' O ' ' X' ' 14' ' ' GLY . 5.2 mm-40 -133.83 150.87 51.42 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.863 0.332 . . . . 0.0 110.166 179.684 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 2.8 m -147.9 129.22 14.77 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 120.776 -0.37 . . . . 0.0 110.159 179.006 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 17' ' ' THR . . . . . . . . . . . . . 2.5 m -130.69 156.79 44.33 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 120.989 0.423 . . . . 0.0 110.544 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 18' ' ' THR . . . . . . . . . . . . . 7.6 t -148.91 152.88 37.17 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 115.881 -0.599 . . . . 0.0 109.545 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 19' ' ' GLU . . . . . 0.422 ' OE2' ' O ' ' X' ' 1' ' ' MET . 1.1 tm-20 -104.21 105.55 15.73 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 -179.679 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 20' ' ' ALA . . . . . 0.419 ' O ' ' O ' ' X' ' 1' ' ' MET . . . -136.66 163.12 31.32 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.69 -179.579 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 21' ' ' VAL . . . . . . . . . . . . . 1.1 p -88.56 -40.78 13.69 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.595 179.26 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 22' ' ' ASP . . . . . 0.426 ' OD1' ' N ' ' X' ' 23' ' ' ALA . 46.5 t0 -103.61 154.41 19.53 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.376 -179.247 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 23' ' ' ALA . . . . . 0.426 ' N ' ' OD1' ' X' ' 22' ' ' ASP . . . -75.08 -43.35 53.61 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.87 179.599 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.34 -39.79 94.59 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.595 -179.148 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 25' ' ' THR . . . . . . . . . . . . . 1.2 t -64.11 -34.2 77.51 Favored 'General case' 0 C--N 1.345 0.405 0 C-N-CA 120.665 -0.414 . . . . 0.0 110.572 -179.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.43 -35.88 78.26 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.877 0.37 . . . . 0.0 110.777 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 27' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -61.58 -28.02 69.05 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.859 -179.6 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 28' ' ' LYS . . . . . . . . . . . . . 83.8 mttt -56.8 -44.27 81.77 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.535 -0.466 . . . . 0.0 110.003 -179.025 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 29' ' ' VAL . . . . . 0.429 ' O ' ' CB ' ' X' ' 33' ' ' TYR . 11.5 t -70.15 -50.92 43.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.647 179.289 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 30' ' ' PHE . . . . . . . . . . . . . 55.0 m-85 -61.8 -43.53 98.67 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.111 -0.495 . . . . 0.0 112.009 -179.019 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 31' ' ' LYS . . . . . . . . . . . . . 67.5 mttt -70.47 -40.94 73.37 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 120.215 -0.594 . . . . 0.0 110.386 -179.627 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 32' ' ' GLN . . . . . . . . . . . . . 3.6 tp-100 -73.17 -33.55 65.52 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 179.168 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 33' ' ' TYR . . . . . 0.429 ' CB ' ' O ' ' X' ' 29' ' ' VAL . 29.2 t80 -66.76 -36.83 83.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.877 -179.848 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 34' ' ' ALA . . . . . 0.459 ' O ' ' OD1' ' X' ' 37' ' ' ASN . . . -59.38 -41.83 90.28 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.492 -179.188 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 35' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -66.67 -37.68 85.27 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 179.209 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 36' ' ' ASP . . . . . 0.491 ' OD1' ' N ' ' X' ' 36' ' ' ASP . 0.9 OUTLIER -67.71 -33.15 74.31 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.404 -0.816 . . . . 0.0 111.938 -179.908 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' X' X ' 37' ' ' ASN . . . . . 0.58 HD22 ' CG1' ' X' ' 39' ' ' VAL . 14.8 p-10 -90.59 -24.57 20.52 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 120.766 -0.374 . . . . 0.0 111.883 -178.301 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 38' ' ' GLY . . . . . 0.535 ' N ' ' OD1' ' X' ' 37' ' ' ASN . . . 118.92 -39.2 2.61 Favored Glycine 0 CA--C 1.533 1.2 0 C-N-CA 121.228 -0.51 . . . . 0.0 113.806 177.752 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 39' ' ' VAL . . . . . 0.58 ' CG1' HD22 ' X' ' 37' ' ' ASN . 1.5 p -80.24 108.29 13.51 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 CA-C-N 117.974 0.887 . . . . 0.0 111.549 -178.042 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 40' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -127.78 111.94 14.21 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 115.762 -0.654 . . . . 0.0 109.861 179.143 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 41' ' ' GLY . . . . . 0.461 ' H ' ' CG2' ' X' ' 54' ' ' VAL . . . -141.82 -154.96 6.3 Favored Glycine 0 CA--C 1.534 1.223 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.149 -179.464 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 42' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -74.98 137.34 41.5 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 110.092 -0.336 . . . . 0.0 110.092 -179.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 43' ' ' TRP . . . . . . . . . . . . . 82.1 m95 -102.97 161.88 13.39 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.767 0.794 . . . . 0.0 112.611 -178.45 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 44' ' ' THR . . . . . 0.481 ' CG2' ' OG1' ' X' ' 53' ' ' THR . 11.3 t -157.01 169.04 25.74 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.181 -1.372 . . . . 0.0 108.368 179.251 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 45' ' ' TYR . . . . . 0.612 ' CD1' ' CE1' ' X' ' 52' ' ' PHE . 3.0 t80 -174.43 135.27 0.42 Allowed 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 119.597 -0.841 . . . . 0.0 111.819 -179.951 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 46' ' ' ASP . . . . . 0.517 ' N ' ' CD1' ' X' ' 45' ' ' TYR . 14.8 t0 -123.68 112.5 17.46 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 115.206 -0.907 . . . . 0.0 108.804 177.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 47' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -66.56 -14.94 63.01 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-O 120.775 0.321 . . . . 0.0 110.831 -179.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.34 -14.53 58.92 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.082 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 49' ' ' THR . . . . . . . . . . . . . 2.7 p -128.27 3.33 5.74 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 121.475 -0.09 . . . . 0.0 110.888 -179.737 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 50' ' ' LYS . . . . . 0.592 ' NZ ' ' SD ' ' X' ' 1' ' ' MET . 68.7 mmtt 41.63 56.7 3.25 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 120.799 -0.36 . . . . 0.0 110.546 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 51' ' ' THR . . . . . . . . . . . . . 86.3 m -146.24 127.84 15.15 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 120.775 0.322 . . . . 0.0 111.828 -179.303 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 52' ' ' PHE . . . . . 0.612 ' CE1' ' CD1' ' X' ' 45' ' ' TYR . 11.0 m-85 -108.2 155.29 20.62 Favored 'General case' 0 C--N 1.343 0.301 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 178.725 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 53' ' ' THR . . . . . 0.481 ' OG1' ' CG2' ' X' ' 44' ' ' THR . 58.8 p -150.97 130.54 13.02 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 120.513 -0.475 . . . . 0.0 110.396 179.277 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 54' ' ' VAL . . . . . 0.461 ' CG2' ' H ' ' X' ' 41' ' ' GLY . 11.4 p -113.58 123.89 69.68 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.408 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 179.243 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 55' ' ' THR . . . . . 0.451 ' CG2' ' O ' ' X' ' 55' ' ' THR . 4.2 t -125.31 120.39 31.03 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.403 -178.715 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 56' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 . . . . . 0 C--O 1.219 -0.517 0 CA-C-O 118.117 -0.944 . . . . 0.0 110.094 179.567 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' X' X ' 1' ' ' MET . . . . . 0.434 ' O ' ' OE2' ' X' ' 19' ' ' GLU . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.609 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 2' ' ' GLN . . . . . . . . . . . . . 80.0 mt-30 -126.85 139.19 53.27 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 120.961 0.41 . . . . 0.0 111.312 -179.497 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 3' ' ' TYR . . . . . 0.636 ' CD1' ' N ' ' X' ' 3' ' ' TYR . 0.1 OUTLIER -119.87 168.74 10.81 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 178.866 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' X' X ' 4' ' ' LYS . . . . . . . . . . . . . 28.7 tttm -135.86 128.78 31.29 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 121.062 -0.255 . . . . 0.0 110.566 -179.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 5' ' ' LEU . . . . . 0.507 HD23 ' N ' ' X' ' 6' ' ' ILE . 1.7 tm? -105.79 126.26 51.96 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 179.633 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 6' ' ' ILE . . . . . 0.507 ' N ' HD23 ' X' ' 5' ' ' LEU . 32.9 mm -98.14 132.54 42.91 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.452 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 179.393 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 7' ' ' LEU . . . . . . . . . . . . . 5.7 mp -92.21 115.25 27.92 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.652 -179.536 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 8' ' ' ASN . . . . . 0.665 ' ND2' ' HG1' ' X' ' 55' ' ' THR . 35.1 t30 -134.55 87.52 2.36 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 177.863 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 9' ' ' GLY . . . . . 0.451 ' H ' ' HD3' ' X' ' 13' ' ' LYS . . . -126.85 -163.0 11.37 Favored Glycine 0 C--N 1.336 0.541 0 N-CA-C 111.291 -0.724 . . . . 0.0 111.291 -179.096 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 10' ' ' LYS . . . . . . . . . . . . . 40.5 mtmt -80.55 -43.02 21.34 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.938 -0.305 . . . . 0.0 110.937 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 11' ' ' THR . . . . . . . . . . . . . 42.3 p -130.54 15.78 5.43 Favored 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 112.3 0.482 . . . . 0.0 112.3 -179.195 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 12' ' ' LEU . . . . . 0.726 ' N ' ' HZ3' ' X' ' 13' ' ' LYS . 0.3 OUTLIER -138.52 100.44 4.09 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 120.842 -0.343 . . . . 0.0 111.642 -179.526 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' X' X ' 13' ' ' LYS . . . . . 0.726 ' HZ3' ' N ' ' X' ' 12' ' ' LEU . 0.0 OUTLIER -122.44 137.77 54.76 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 178.829 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' X' X ' 14' ' ' GLY . . . . . . . . . . . . . . . 173.17 -154.6 20.85 Favored Glycine 0 CA--C 1.533 1.184 0 N-CA-C 111.082 -0.807 . . . . 0.0 111.082 -179.73 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 15' ' ' GLU . . . . . . . . . . . . . 56.8 mm-40 -131.8 152.74 50.76 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.595 0.236 . . . . 0.0 110.469 179.613 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 16' ' ' THR . . . . . 0.414 ' OG1' ' O ' ' X' ' 5' ' ' LEU . 0.2 OUTLIER -148.23 154.85 40.62 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 120.969 0.414 . . . . 0.0 110.441 179.716 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' X' X ' 17' ' ' THR . . . . . . . . . . . . . 2.0 m -145.96 158.93 43.86 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.737 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 18' ' ' THR . . . . . . . . . . . . . 4.4 t -153.08 151.2 29.94 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-N 116.203 -0.453 . . . . 0.0 109.885 179.069 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 19' ' ' GLU . . . . . 0.434 ' OE2' ' O ' ' X' ' 1' ' ' MET . 0.8 OUTLIER -106.55 110.81 23.12 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.089 179.769 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' X' X ' 20' ' ' ALA . . . . . . . . . . . . . . . -147.57 162.12 39.75 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.055 0.455 . . . . 0.0 110.597 179.766 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 21' ' ' VAL . . . . . . . . . . . . . 1.1 p -87.0 -41.38 14.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.717 179.561 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 22' ' ' ASP . . . . . . . . . . . . . 68.6 m-20 -103.86 151.82 22.66 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.482 -179.033 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.43 -37.46 63.31 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.298 -0.864 . . . . 0.0 110.872 179.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 24' ' ' ALA . . . . . . . . . . . . . . . -70.49 -38.23 74.33 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.332 -179.197 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 25' ' ' THR . . . . . . . . . . . . . 1.1 t -67.29 -29.82 69.52 Favored 'General case' 0 C--N 1.345 0.408 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.621 -179.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.55 -35.77 79.69 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.495 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 27' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -58.31 -30.4 66.63 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.579 -179.771 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 28' ' ' LYS . . . . . . . . . . . . . 41.7 mtmt -57.34 -39.52 76.09 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.472 -0.491 . . . . 0.0 110.181 -178.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 29' ' ' VAL . . . . . 0.415 ' O ' ' CB ' ' X' ' 33' ' ' TYR . 13.0 t -70.02 -51.47 39.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.543 179.33 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 30' ' ' PHE . . . . . . . . . . . . . 40.8 m-85 -64.59 -42.97 95.25 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.859 -179.412 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 31' ' ' LYS . . . . . . . . . . . . . 2.8 tppt? -61.46 -49.2 77.75 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 120.282 -0.567 . . . . 0.0 110.78 -179.478 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 32' ' ' GLN . . . . . . . . . . . . . 89.6 mt-30 -73.08 -38.36 66.44 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.838 -179.746 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 33' ' ' TYR . . . . . 0.528 ' CZ ' ' OD1' ' X' ' 37' ' ' ASN . 69.8 t80 -61.8 -37.47 84.51 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.645 -179.797 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.27 -38.06 79.17 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.39 -179.325 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 35' ' ' ASN . . . . . . . . . . . . . 10.0 m-20 -61.18 -48.17 82.78 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 179.504 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 36' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -66.81 -24.7 66.2 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.02 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 37' ' ' ASN . . . . . 0.528 ' OD1' ' CZ ' ' X' ' 33' ' ' TYR . 1.0 OUTLIER -87.27 -26.08 23.63 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 116.471 -0.332 . . . . 0.0 110.996 -178.943 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' X' X ' 38' ' ' GLY . . . . . . . . . . . . . . . 106.08 -36.91 4.1 Favored Glycine 0 CA--C 1.53 1.019 0 C-N-CA 121.359 -0.448 . . . . 0.0 112.563 178.626 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 39' ' ' VAL . . . . . 0.406 ' H ' HG11 ' X' ' 39' ' ' VAL . 3.1 p -79.96 107.74 12.68 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.39 0 CA-C-N 117.575 0.687 . . . . 0.0 110.983 -179.096 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 40' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -128.12 110.83 12.83 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.888 179.358 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 41' ' ' GLY . . . . . 0.447 ' H ' ' CG2' ' X' ' 54' ' ' VAL . . . -141.86 -155.72 6.56 Favored Glycine 0 CA--C 1.531 1.064 0 C-N-CA 120.683 -0.77 . . . . 0.0 111.943 -179.69 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 42' ' ' GLU . . . . . . . . . . . . . 10.9 mt-10 -74.99 133.62 41.65 Favored 'General case' 0 N--CA 1.446 -0.631 0 N-CA-C 110.129 -0.323 . . . . 0.0 110.129 -179.803 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 43' ' ' TRP . . . . . . . . . . . . . 90.6 m95 -99.19 162.36 13.1 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.476 0.655 . . . . 0.0 111.892 -178.541 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 44' ' ' THR . . . . . 0.507 ' CG2' ' OG1' ' X' ' 53' ' ' THR . 2.5 t -156.9 167.11 31.46 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 114.845 -1.071 . . . . 0.0 109.492 179.783 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 45' ' ' TYR . . . . . 0.63 ' CD1' ' CZ ' ' X' ' 52' ' ' PHE . 64.7 t80 -166.52 136.7 3.24 Favored 'General case' 0 CA--C 1.519 -0.241 0 C-N-CA 120.116 -0.634 . . . . 0.0 111.958 179.739 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 46' ' ' ASP . . . . . . . . . . . . . 18.8 t0 -123.44 111.79 16.76 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 177.523 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 47' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -67.11 -15.74 63.9 Favored 'General case' 0 C--O 1.231 0.095 0 CA-C-O 120.882 0.372 . . . . 0.0 110.751 -179.708 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.35 -18.09 53.17 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.115 -179.698 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 49' ' ' THR . . . . . . . . . . . . . 2.6 p -128.2 2.74 5.79 Favored 'General case' 0 N--CA 1.469 0.521 0 N-CA-C 110.626 -0.139 . . . . 0.0 110.626 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 50' ' ' LYS . . . . . . . . . . . . . 65.7 mmtt 39.64 55.69 2.39 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-O 120.583 0.23 . . . . 0.0 110.712 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 51' ' ' THR . . . . . . . . . . . . . 99.7 m -138.31 129.65 27.48 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.018 -179.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 52' ' ' PHE . . . . . 0.63 ' CZ ' ' CD1' ' X' ' 45' ' ' TYR . 87.3 m-85 -107.29 154.26 21.52 Favored 'General case' 0 C--N 1.342 0.281 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 179.46 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 53' ' ' THR . . . . . 0.507 ' OG1' ' CG2' ' X' ' 44' ' ' THR . 24.2 p -151.9 130.44 12.23 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 120.599 -0.44 . . . . 0.0 110.253 178.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 54' ' ' VAL . . . . . 0.447 ' CG2' ' H ' ' X' ' 41' ' ' GLY . 10.6 p -113.42 123.7 69.33 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 178.871 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 55' ' ' THR . . . . . 0.665 ' HG1' ' ND2' ' X' ' 8' ' ' ASN . 4.8 t -125.35 120.7 31.84 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.511 -178.425 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 56' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 . . . . . 0 C--O 1.22 -0.461 0 CA-C-O 118.073 -0.965 . . . . 0.0 110.136 179.252 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' X' X ' 1' ' ' MET . . . . . 0.596 ' SD ' ' CZ ' ' X' ' 3' ' ' TYR . 0.7 OUTLIER . . . . . 0 N--CA 1.493 1.685 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 . . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 2' ' ' GLN . . . . . . . . . . . . . 15.5 mm-40 -113.33 134.13 54.78 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.049 0.452 . . . . 0.0 110.92 -179.335 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 3' ' ' TYR . . . . . 0.596 ' CZ ' ' SD ' ' X' ' 1' ' ' MET . 38.1 m-85 -125.61 137.01 53.87 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.771 -0.65 . . . . 0.0 109.412 179.17 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 4' ' ' LYS . . . . . . . . . . . . . 44.8 tttp -119.97 128.06 53.22 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 120.923 0.392 . . . . 0.0 110.703 -179.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 5' ' ' LEU . . . . . 0.446 ' CD1' ' C ' ' X' ' 5' ' ' LEU . 1.0 OUTLIER -109.29 127.94 54.69 Favored 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 179.435 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' X' X ' 6' ' ' ILE . . . . . 0.406 ' N ' HD21 ' X' ' 5' ' ' LEU . 27.0 mm -98.99 132.35 44.51 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 CA-C-O 120.948 0.404 . . . . 0.0 110.176 -179.386 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 7' ' ' LEU . . . . . . . . . . . . . 6.0 mp -92.66 110.24 21.66 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.664 -179.19 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 8' ' ' ASN . . . . . . . . . . . . . 12.7 t30 -132.91 87.52 2.41 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 178.298 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 9' ' ' GLY . . . . . 0.725 ' H ' ' HZ2' ' X' ' 13' ' ' LYS . . . -122.79 -147.35 7.39 Favored Glycine 0 N--CA 1.464 0.537 0 N-CA-C 111.462 -0.655 . . . . 0.0 111.462 -179.203 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 10' ' ' LYS . . . . . . . . . . . . . 57.1 mttt -79.17 -50.15 11.43 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 120.989 -0.284 . . . . 0.0 111.46 -179.486 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 11' ' ' THR . . . . . . . . . . . . . 41.5 p -130.35 -19.62 3.09 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 -179.427 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 12' ' ' LEU . . . . . 0.673 ' N ' ' HZ1' ' X' ' 13' ' ' LYS . 0.5 OUTLIER -92.15 119.51 31.87 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-O 120.648 0.261 . . . . 0.0 111.156 -178.943 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' X' X ' 13' ' ' LYS . . . . . 0.725 ' HZ2' ' H ' ' X' ' 9' ' ' GLY . 0.1 OUTLIER -140.18 139.24 35.66 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 120.907 0.384 . . . . 0.0 110.255 179.449 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' X' X ' 14' ' ' GLY . . . . . 0.438 ' O ' ' OE1' ' X' ' 15' ' ' GLU . . . 173.79 -155.01 21.13 Favored Glycine 0 CA--C 1.533 1.216 0 N-CA-C 110.671 -0.972 . . . . 0.0 110.671 -179.933 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 15' ' ' GLU . . . . . 0.438 ' OE1' ' O ' ' X' ' 14' ' ' GLY . 5.0 mm-40 -133.82 151.09 51.46 Favored 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 110.098 -0.334 . . . . 0.0 110.098 179.622 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 2.8 m -147.86 129.18 14.78 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.052 178.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 17' ' ' THR . . . . . . . . . . . . . 2.4 m -129.47 157.05 43.08 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-O 121.003 0.43 . . . . 0.0 110.551 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 18' ' ' THR . . . . . . . . . . . . . 7.2 t -150.55 152.69 34.52 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.601 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 19' ' ' GLU . . . . . 0.443 ' OE2' ' O ' ' X' ' 1' ' ' MET . 1.2 tm-20 -104.42 105.61 15.8 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.846 -0.427 . . . . 0.0 109.846 -179.626 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 20' ' ' ALA . . . . . 0.521 ' O ' ' N ' ' X' ' 1' ' ' MET . . . -136.39 163.29 30.79 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.728 -179.668 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 21' ' ' VAL . . . . . . . . . . . . . 1.1 p -89.04 -41.23 13.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.358 179.356 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 22' ' ' ASP . . . . . . . . . . . . . 46.5 t0 -102.27 152.71 20.74 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.335 -179.267 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 23' ' ' ALA . . . . . . . . . . . . . . . -75.14 -39.68 60.28 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.73 179.645 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 24' ' ' ALA . . . . . . . . . . . . . . . -67.51 -39.84 85.12 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.332 -179.087 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 25' ' ' THR . . . . . . . . . . . . . 1.2 t -64.24 -33.33 75.57 Favored 'General case' 0 C--N 1.345 0.409 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.62 -179.73 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.12 -35.99 79.01 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.973 0.416 . . . . 0.0 110.681 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 27' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -62.88 -28.43 70.03 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.594 -179.607 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 28' ' ' LYS . . . . . . . . . . . . . 83.5 mttt -57.17 -43.77 82.9 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 120.588 -0.445 . . . . 0.0 109.805 -179.163 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 29' ' ' VAL . . . . . 0.451 ' O ' ' N ' ' X' ' 33' ' ' TYR . 11.9 t -70.24 -50.88 43.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.588 179.296 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 30' ' ' PHE . . . . . . . . . . . . . 56.0 m-85 -61.76 -43.93 97.88 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.181 -0.463 . . . . 0.0 112.011 -179.236 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 31' ' ' LYS . . . . . . . . . . . . . 69.7 mttt -69.26 -41.76 76.48 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 120.173 -0.611 . . . . 0.0 110.281 -179.794 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 32' ' ' GLN . . . . . . . . . . . . . 59.6 tp60 -73.2 -33.14 65.22 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.038 0.447 . . . . 0.0 110.039 179.226 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 33' ' ' TYR . . . . . 0.451 ' N ' ' O ' ' X' ' 29' ' ' VAL . 69.3 t80 -71.23 -42.18 69.2 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.12 -179.794 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 34' ' ' ALA . . . . . . . . . . . . . . . -58.73 -38.08 77.58 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 120.839 -0.344 . . . . 0.0 110.4 -179.09 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 35' ' ' ASN . . . . . . . . . . . . . 40.3 t-20 -63.19 -45.54 91.27 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 179.042 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 36' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -66.81 -25.02 66.25 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.622 179.415 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 37' ' ' ASN . . . . . 0.407 ' ND2' ' CE2' ' X' ' 33' ' ' TYR . 0.9 OUTLIER -85.09 -26.53 26.89 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.983 -178.839 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' X' X ' 38' ' ' GLY . . . . . . . . . . . . . . . 113.19 -37.91 3.43 Favored Glycine 0 CA--C 1.531 1.052 0 C-N-CA 121.541 -0.362 . . . . 0.0 112.973 178.354 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 39' ' ' VAL . . . . . . . . . . . . . 1.5 p -80.63 108.64 14.22 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.394 0 CA-C-N 117.73 0.765 . . . . 0.0 111.161 -178.551 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 40' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -127.42 110.85 13.2 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.677 179.172 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 41' ' ' GLY . . . . . 0.439 ' H ' ' CG2' ' X' ' 54' ' ' VAL . . . -142.26 -155.17 6.35 Favored Glycine 0 CA--C 1.532 1.11 0 C-N-CA 120.606 -0.807 . . . . 0.0 111.981 -179.407 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 42' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -75.12 132.06 40.95 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-O 120.885 0.374 . . . . 0.0 110.152 -179.699 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 43' ' ' TRP . . . . . . . . . . . . . 81.5 m95 -97.92 161.41 13.75 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.65 0.738 . . . . 0.0 112.05 -178.672 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 44' ' ' THR . . . . . 0.502 ' CG2' ' OG1' ' X' ' 53' ' ' THR . 2.5 t -157.0 169.07 25.66 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 114.509 -1.223 . . . . 0.0 108.885 179.483 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 45' ' ' TYR . . . . . 0.615 ' CD1' ' CE1' ' X' ' 52' ' ' PHE . 2.6 t80 -173.9 135.55 0.5 Allowed 'General case' 0 C--N 1.331 -0.21 0 C-N-CA 119.697 -0.801 . . . . 0.0 111.691 -179.917 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 46' ' ' ASP . . . . . 0.539 ' N ' ' CD1' ' X' ' 45' ' ' TYR . 8.1 t0 -123.84 112.6 17.47 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 115.155 -0.929 . . . . 0.0 108.872 178.067 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 47' ' ' ASP . . . . . 0.511 ' OD1' ' NZ ' ' X' ' 50' ' ' LYS . 25.0 t0 -66.47 -15.48 63.38 Favored 'General case' 0 C--O 1.23 0.057 0 CA-C-O 120.728 0.299 . . . . 0.0 110.856 -179.722 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.51 -14.88 58.57 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.069 -179.702 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 49' ' ' THR . . . . . . . . . . . . . 2.7 p -128.28 3.84 5.75 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 121.394 -0.122 . . . . 0.0 110.792 -179.656 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 50' ' ' LYS . . . . . 0.587 ' NZ ' ' SD ' ' X' ' 1' ' ' MET . 64.3 mmtt 40.89 57.34 2.74 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 120.922 -0.311 . . . . 0.0 110.693 -179.885 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 51' ' ' THR . . . . . . . . . . . . . 85.1 m -146.62 127.88 14.81 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 120.725 0.298 . . . . 0.0 111.747 -179.435 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 52' ' ' PHE . . . . . 0.615 ' CE1' ' CD1' ' X' ' 45' ' ' TYR . 10.5 m-85 -107.64 154.11 21.92 Favored 'General case' 0 C--N 1.342 0.261 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 178.749 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 53' ' ' THR . . . . . 0.502 ' OG1' ' CG2' ' X' ' 44' ' ' THR . 36.4 p -150.97 130.36 12.88 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 120.447 -0.501 . . . . 0.0 110.187 179.07 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 54' ' ' VAL . . . . . 0.439 ' CG2' ' H ' ' X' ' 41' ' ' GLY . 14.4 p -113.51 123.92 69.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 179.192 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 55' ' ' THR . . . . . 0.437 ' CG2' ' O ' ' X' ' 55' ' ' THR . 4.3 t -125.24 121.38 33.91 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.525 -178.599 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 56' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 . . . . . 0 C--O 1.219 -0.533 0 CA-C-O 118.067 -0.968 . . . . 0.0 110.035 179.499 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' X' X ' 1' ' ' MET . . . . . 0.6 ' SD ' ' NZ ' ' X' ' 50' ' ' LYS . 0.4 OUTLIER . . . . . 0 N--CA 1.494 1.771 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 2' ' ' GLN . . . . . . . . . . . . . 83.6 mt-30 -127.14 137.54 52.99 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.004 0.43 . . . . 0.0 111.51 -179.135 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 3' ' ' TYR . . . . . 0.48 ' OH ' ' CE ' ' X' ' 1' ' ' MET . 62.6 m-85 -116.93 139.63 50.42 Favored 'General case' 0 CA--C 1.517 -0.303 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 178.729 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 4' ' ' LYS . . . . . . . . . . . . . 52.3 tttp -120.93 127.83 52.19 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-O 120.911 0.386 . . . . 0.0 110.925 -179.3 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 5' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -105.01 129.0 53.56 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 179.08 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 6' ' ' ILE . . . . . . . . . . . . . 32.1 mm -100.94 129.79 51.31 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.419 0 N-CA-C 109.63 -0.508 . . . . 0.0 109.63 178.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 7' ' ' LEU . . . . . 0.506 ' CD1' ' HG1' ' X' ' 16' ' ' THR . 5.1 mp -93.43 110.04 21.61 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.771 -179.587 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 8' ' ' ASN . . . . . 0.523 ' N ' ' OD1' ' X' ' 8' ' ' ASN . 5.1 p-10 -134.83 87.36 2.33 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 178.039 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 9' ' ' GLY . . . . . 0.764 ' H ' ' HZ1' ' X' ' 13' ' ' LYS . . . -122.24 -145.84 7.13 Favored Glycine 0 N--CA 1.464 0.546 0 N-CA-C 111.527 -0.629 . . . . 0.0 111.527 -179.302 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 10' ' ' LYS . . . . . . . . . . . . . 41.2 mtmt -80.61 -49.49 11.21 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 121.157 -0.217 . . . . 0.0 111.551 -179.381 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 11' ' ' THR . . . . . . . . . . . . . 41.6 p -129.97 -19.45 3.24 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -179.34 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 12' ' ' LEU . . . . . 0.679 ' N ' ' HZ3' ' X' ' 13' ' ' LYS . 0.4 OUTLIER -93.12 119.18 32.05 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 120.624 0.249 . . . . 0.0 111.066 -178.954 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' X' X ' 13' ' ' LYS . . . . . 0.764 ' HZ1' ' H ' ' X' ' 9' ' ' GLY . 0.1 OUTLIER -141.52 139.21 33.19 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-O 120.974 0.416 . . . . 0.0 110.351 179.351 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' X' X ' 14' ' ' GLY . . . . . 0.438 ' O ' ' OE1' ' X' ' 15' ' ' GLU . . . 173.62 -155.11 21.52 Favored Glycine 0 CA--C 1.533 1.195 0 N-CA-C 110.771 -0.932 . . . . 0.0 110.771 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 15' ' ' GLU . . . . . 0.438 ' OE1' ' O ' ' X' ' 14' ' ' GLY . 6.6 mm-40 -129.72 154.64 46.97 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.85 0.357 . . . . 0.0 110.218 179.553 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 16' ' ' THR . . . . . 0.506 ' HG1' ' CD1' ' X' ' 7' ' ' LEU . 0.0 OUTLIER -147.54 145.47 29.09 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.067 179.797 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' X' X ' 17' ' ' THR . . . . . . . . . . . . . 1.8 m -146.11 157.25 43.84 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.943 0.401 . . . . 0.0 111.048 179.23 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 18' ' ' THR . . . . . . . . . . . . . 7.4 t -155.24 152.9 29.86 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.102 179.636 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 19' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -104.42 105.91 16.21 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 179.805 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 20' ' ' ALA . . . . . . . . . . . . . . . -130.64 159.01 38.48 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 121.107 0.48 . . . . 0.0 110.793 -179.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 21' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -82.14 -41.09 17.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.316 179.118 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 22' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -111.56 157.3 20.53 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.131 -179.45 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.88 -42.92 56.93 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.659 -0.701 . . . . 0.0 111.133 179.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 24' ' ' ALA . . . . . . . . . . . . . . . -66.34 -41.38 89.66 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.563 -178.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 25' ' ' THR . . . . . . . . . . . . . 1.2 t -59.63 -35.61 74.72 Favored 'General case' 0 C--N 1.345 0.406 0 C-N-CA 120.734 -0.386 . . . . 0.0 110.716 -179.619 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.85 -35.02 77.84 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.924 0.392 . . . . 0.0 110.655 -179.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 27' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -57.25 -29.32 63.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.806 -179.317 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 28' ' ' LYS . . . . . . . . . . . . . 41.8 mtmt -57.34 -43.85 83.77 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.234 -178.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 29' ' ' VAL . . . . . 0.444 ' O ' ' CB ' ' X' ' 33' ' ' TYR . 19.1 t -69.47 -46.35 76.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.174 179.168 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 30' ' ' PHE . . . . . . . . . . . . . 8.4 m-30 -61.52 -43.41 98.91 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.308 -179.621 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 31' ' ' LYS . . . . . . . . . . . . . 2.4 tppt? -63.14 -50.1 71.76 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 120.335 -0.546 . . . . 0.0 110.763 -179.459 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 32' ' ' GLN . . . . . . . . . . . . . 93.7 mm-40 -73.52 -34.44 65.24 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.317 -179.659 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 33' ' ' TYR . . . . . 0.521 ' CZ ' ' OD1' ' X' ' 37' ' ' ASN . 69.0 t80 -61.74 -43.48 98.78 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.88 -179.535 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.11 -37.63 77.65 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.421 -179.082 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 35' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -64.18 -47.22 80.65 Favored 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 179.221 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 36' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -66.87 -26.08 66.72 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.645 179.602 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 37' ' ' ASN . . . . . 0.521 ' OD1' ' CZ ' ' X' ' 33' ' ' TYR . 1.1 m120 -84.0 -26.66 28.99 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.807 -179.283 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 38' ' ' GLY . . . . . . . . . . . . . . . 112.15 -39.25 2.93 Favored Glycine 0 CA--C 1.531 1.076 0 C-N-CA 121.555 -0.355 . . . . 0.0 112.364 178.622 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 39' ' ' VAL . . . . . . . . . . . . . 1.6 p -80.78 108.75 14.46 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 CA-C-N 117.4 0.6 . . . . 0.0 111.211 -178.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 40' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -127.71 112.31 14.67 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.737 179.306 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 41' ' ' GLY . . . . . 0.405 ' H ' ' CG2' ' X' ' 54' ' ' VAL . . . -142.92 -153.73 5.96 Favored Glycine 0 CA--C 1.533 1.197 0 C-N-CA 120.337 -0.935 . . . . 0.0 112.283 -179.431 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 42' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -74.53 139.13 43.58 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 -179.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 43' ' ' TRP . . . . . . . . . . . . . 90.8 m95 -102.83 162.36 12.99 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.817 0.817 . . . . 0.0 112.686 -178.052 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 44' ' ' THR . . . . . 0.5 ' CG2' ' OG1' ' X' ' 53' ' ' THR . 2.8 t -156.9 167.85 29.23 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.35 -1.295 . . . . 0.0 108.821 179.206 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 45' ' ' TYR . . . . . 0.629 ' CD1' ' CE1' ' X' ' 52' ' ' PHE . 19.1 t80 -172.88 134.45 0.59 Allowed 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 119.748 -0.781 . . . . 0.0 111.771 179.992 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 46' ' ' ASP . . . . . 0.414 ' OD2' ' OG1' ' X' ' 49' ' ' THR . 11.6 t0 -123.66 112.33 17.27 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 115.25 -0.886 . . . . 0.0 108.708 177.87 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 47' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -68.61 -16.33 63.81 Favored 'General case' 0 C--O 1.231 0.121 0 CA-C-O 120.815 0.341 . . . . 0.0 110.988 -179.552 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.16 -13.56 59.64 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.101 -179.824 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 49' ' ' THR . . . . . 0.414 ' OG1' ' OD2' ' X' ' 46' ' ' ASP . 2.5 p -128.22 3.0 5.77 Favored 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 110.508 -0.182 . . . . 0.0 110.508 -179.793 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 50' ' ' LYS . . . . . 0.6 ' NZ ' ' SD ' ' X' ' 1' ' ' MET . 64.5 mmtt 41.54 57.48 2.99 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 120.908 -0.317 . . . . 0.0 110.544 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 51' ' ' THR . . . . . . . . . . . . . 96.9 m -147.01 128.67 15.17 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 111.891 0.33 . . . . 0.0 111.891 -179.346 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 52' ' ' PHE . . . . . 0.629 ' CE1' ' CD1' ' X' ' 45' ' ' TYR . 27.9 m-85 -107.84 156.23 19.39 Favored 'General case' 0 C--N 1.345 0.376 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 178.717 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 53' ' ' THR . . . . . 0.5 ' OG1' ' CG2' ' X' ' 44' ' ' THR . 11.6 p -152.14 128.83 10.82 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 178.767 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 54' ' ' VAL . . . . . 0.405 ' CG2' ' H ' ' X' ' 41' ' ' GLY . 10.4 p -112.74 123.98 68.95 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 178.776 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 55' ' ' THR . . . . . 0.425 ' CG2' ' O ' ' X' ' 55' ' ' THR . 3.0 t -124.93 123.27 39.54 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 116.561 -0.291 . . . . 0.0 111.708 -178.053 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 56' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 . . . . . 0 C--O 1.22 -0.494 0 CA-C-O 118.015 -0.993 . . . . 0.0 110.062 179.36 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' X' X ' 1' ' ' MET . . . . . 0.588 ' SD ' ' CZ ' ' X' ' 3' ' ' TYR . 0.1 OUTLIER . . . . . 0 N--CA 1.493 1.683 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 2' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -126.28 146.23 50.1 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.908 0.385 . . . . 0.0 110.622 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 3' ' ' TYR . . . . . 0.588 ' CZ ' ' SD ' ' X' ' 1' ' ' MET . 73.5 m-85 -115.3 142.66 46.38 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.463 179.462 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 4' ' ' LYS . . . . . . . . . . . . . 10.1 ttmm -119.45 127.2 52.86 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 121.024 0.44 . . . . 0.0 110.187 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 5' ' ' LEU . . . . . 0.44 ' CD1' ' C ' ' X' ' 5' ' ' LEU . 1.0 OUTLIER -107.8 127.64 53.89 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 179.664 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' X' X ' 6' ' ' ILE . . . . . 0.402 ' N ' HD23 ' X' ' 5' ' ' LEU . 29.2 mm -98.4 132.24 43.9 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.467 0 CA-C-O 120.907 0.384 . . . . 0.0 110.073 -179.474 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 7' ' ' LEU . . . . . . . . . . . . . 6.2 mp -91.91 113.62 25.94 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.283 -179.156 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 8' ' ' ASN . . . . . 0.534 ' ND2' ' HG1' ' X' ' 55' ' ' THR . 20.2 t30 -131.78 87.73 2.48 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 178.165 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 9' ' ' GLY . . . . . 0.535 ' H ' ' NZ ' ' X' ' 13' ' ' LYS . . . -124.62 -163.24 11.62 Favored Glycine 0 N--CA 1.463 0.48 0 N-CA-C 111.542 -0.623 . . . . 0.0 111.542 -178.68 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 10' ' ' LYS . . . . . . . . . . . . . 55.5 mttt -75.94 -48.86 19.56 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 120.86 -0.336 . . . . 0.0 110.982 -179.692 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 11' ' ' THR . . . . . . . . . . . . . 41.3 p -130.73 19.3 5.12 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 112.177 0.436 . . . . 0.0 112.177 -179.301 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 12' ' ' LEU . . . . . 0.708 ' H ' ' HZ2' ' X' ' 13' ' ' LYS . 0.5 OUTLIER -138.4 108.12 6.26 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 120.848 0.356 . . . . 0.0 111.337 -179.435 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' X' X ' 13' ' ' LYS . . . . . 0.708 ' HZ2' ' H ' ' X' ' 12' ' ' LEU . 0.2 OUTLIER -131.78 139.94 49.06 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.264 179.429 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' X' X ' 14' ' ' GLY . . . . . . . . . . . . . . . 174.6 -155.19 20.59 Favored Glycine 0 CA--C 1.535 1.323 0 N-CA-C 110.839 -0.905 . . . . 0.0 110.839 -179.794 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 15' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -134.4 149.94 50.84 Favored 'General case' 0 N--CA 1.468 0.449 0 O-C-N 122.717 -0.284 . . . . 0.0 110.517 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 2.7 m -148.28 129.5 14.64 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 120.88 -0.328 . . . . 0.0 110.343 178.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 17' ' ' THR . . . . . . . . . . . . . 2.6 m -131.66 157.24 44.23 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 120.92 0.39 . . . . 0.0 110.451 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 18' ' ' THR . . . . . . . . . . . . . 7.1 t -152.67 152.81 32.17 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.087 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 19' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -104.2 105.86 16.16 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.785 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 20' ' ' ALA . . . . . . . . . . . . . . . -130.01 162.64 28.24 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.998 -179.336 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 21' ' ' VAL . . . . . . . . . . . . . 1.2 p -82.98 -37.58 13.95 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.268 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.716 179.515 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 22' ' ' ASP . . . . . 0.509 ' OD1' ' N ' ' X' ' 23' ' ' ALA . 33.0 t0 -115.47 156.25 25.99 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.943 -179.532 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 23' ' ' ALA . . . . . 0.509 ' N ' ' OD1' ' X' ' 22' ' ' ASP . . . -74.94 -42.78 57.01 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.026 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 24' ' ' ALA . . . . . . . . . . . . . . . -65.71 -39.26 91.01 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.669 -179.054 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 25' ' ' THR . . . . . . . . . . . . . 1.2 t -63.21 -34.57 77.93 Favored 'General case' 0 C--N 1.346 0.437 0 C-N-CA 120.669 -0.413 . . . . 0.0 110.7 -179.561 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.0 -35.82 78.96 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.904 0.383 . . . . 0.0 110.73 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 27' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -58.27 -29.08 65.53 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.665 -179.779 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 28' ' ' LYS . . . . . 0.416 ' O ' ' OE1' ' X' ' 32' ' ' GLN . 41.4 mtmt -57.22 -43.49 82.86 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 120.456 -0.498 . . . . 0.0 110.031 -179.079 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 29' ' ' VAL . . . . . 0.43 ' O ' ' CB ' ' X' ' 33' ' ' TYR . 12.1 t -69.95 -50.76 45.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.459 179.394 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 30' ' ' PHE . . . . . . . . . . . . . 57.9 m-85 -61.54 -43.15 99.39 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.878 -179.319 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 31' ' ' LYS . . . . . . . . . . . . . 68.1 mttt -70.52 -41.78 72.14 Favored 'General case' 0 C--O 1.232 0.155 0 C-N-CA 120.23 -0.588 . . . . 0.0 110.55 -179.499 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 32' ' ' GLN . . . . . 0.416 ' OE1' ' O ' ' X' ' 28' ' ' LYS . 79.2 mt-30 -73.14 -33.52 65.55 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.02 0.438 . . . . 0.0 109.853 179.218 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 33' ' ' TYR . . . . . 0.43 ' CB ' ' O ' ' X' ' 29' ' ' VAL . 27.2 t80 -64.98 -37.62 88.24 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.518 179.844 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 34' ' ' ALA . . . . . 0.46 ' O ' ' OD1' ' X' ' 37' ' ' ASN . . . -59.68 -40.18 86.98 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.611 -179.456 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 35' ' ' ASN . . . . . . . . . . . . . 9.6 m-80 -68.24 -38.44 81.85 Favored 'General case' 0 N--CA 1.456 -0.151 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 179.326 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 36' ' ' ASP . . . . . 0.477 ' OD1' ' N ' ' X' ' 36' ' ' ASP . 0.9 OUTLIER -67.51 -32.15 72.76 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 115.492 -0.776 . . . . 0.0 112.055 -179.866 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' X' X ' 37' ' ' ASN . . . . . 0.595 HD22 ' CG1' ' X' ' 39' ' ' VAL . 17.8 p-10 -91.78 -24.73 19.32 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 -178.431 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 38' ' ' GLY . . . . . 0.543 ' N ' ' OD1' ' X' ' 37' ' ' ASN . . . 118.55 -37.98 3.04 Favored Glycine 0 CA--C 1.534 1.278 0 C-N-CA 121.236 -0.507 . . . . 0.0 113.886 177.726 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 39' ' ' VAL . . . . . 0.595 ' CG1' HD22 ' X' ' 37' ' ' ASN . 1.5 p -80.16 108.39 13.56 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 CA-C-N 118.009 0.905 . . . . 0.0 111.442 -178.064 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 40' ' ' ASP . . . . . . . . . . . . . 22.0 t0 -127.79 111.76 14.01 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.907 179.267 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 41' ' ' GLY . . . . . 0.452 ' H ' ' CG2' ' X' ' 54' ' ' VAL . . . -141.23 -155.37 6.46 Favored Glycine 0 CA--C 1.534 1.27 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.038 -179.589 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 42' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -75.0 136.76 41.25 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-O 120.702 0.287 . . . . 0.0 110.266 -179.682 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 43' ' ' TRP . . . . . . . . . . . . . 82.4 m95 -103.23 162.01 13.33 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.898 0.856 . . . . 0.0 112.535 -178.3 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 44' ' ' THR . . . . . 0.475 ' CG2' ' OG1' ' X' ' 53' ' ' THR . 9.0 t -157.06 166.99 31.76 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 114.071 -1.422 . . . . 0.0 108.384 179.103 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 45' ' ' TYR . . . . . 0.629 ' CE1' ' CE1' ' X' ' 52' ' ' PHE . 16.8 t80 -172.46 133.78 0.65 Allowed 'General case' 0 C--N 1.332 -0.195 0 C-N-CA 119.607 -0.837 . . . . 0.0 112.079 179.943 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 46' ' ' ASP . . . . . 0.421 ' OD2' ' OG1' ' X' ' 49' ' ' THR . 7.9 t0 -123.9 112.47 17.29 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 115.125 -0.943 . . . . 0.0 108.482 177.673 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 47' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -67.69 -16.29 64.07 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-O 120.672 0.272 . . . . 0.0 111.068 -179.388 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.35 -14.81 58.73 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.141 -179.77 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 49' ' ' THR . . . . . 0.421 ' OG1' ' OD2' ' X' ' 46' ' ' ASP . 2.8 p -125.73 2.8 7.48 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 110.44 -0.208 . . . . 0.0 110.44 -179.866 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 50' ' ' LYS . . . . . . . . . . . . . 67.0 mmtt 41.61 58.46 2.74 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 120.884 -0.326 . . . . 0.0 110.551 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 51' ' ' THR . . . . . . . . . . . . . 97.4 m -147.71 126.69 12.8 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 112.132 0.419 . . . . 0.0 112.132 -179.34 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 52' ' ' PHE . . . . . 0.629 ' CE1' ' CE1' ' X' ' 45' ' ' TYR . 26.8 m-85 -107.92 155.55 20.18 Favored 'General case' 0 C--N 1.344 0.352 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 178.436 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 53' ' ' THR . . . . . 0.475 ' OG1' ' CG2' ' X' ' 44' ' ' THR . 47.0 p -151.98 129.49 11.43 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 120.401 -0.52 . . . . 0.0 110.492 179.202 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 54' ' ' VAL . . . . . 0.452 ' CG2' ' H ' ' X' ' 41' ' ' GLY . 10.7 p -113.69 123.62 69.53 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.497 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 178.964 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 55' ' ' THR . . . . . 0.534 ' HG1' ' ND2' ' X' ' 8' ' ' ASN . 4.9 t -125.46 119.89 29.46 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.299 -178.716 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 56' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 . . . . . 0 C--O 1.219 -0.507 0 CA-C-O 118.009 -0.996 . . . . 0.0 110.088 179.635 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' X' X ' 1' ' ' MET . . . . . 0.599 ' SD ' ' NZ ' ' X' ' 50' ' ' LYS . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.665 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 . . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 2' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -127.19 145.18 50.85 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 120.908 0.385 . . . . 0.0 110.972 -179.623 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 3' ' ' TYR . . . . . 0.48 ' OH ' ' CE ' ' X' ' 1' ' ' MET . 61.3 m-85 -122.36 137.68 54.77 Favored 'General case' 0 CA--C 1.518 -0.259 0 CA-C-N 115.835 -0.621 . . . . 0.0 109.495 179.213 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 4' ' ' LYS . . . . . . . . . . . . . 45.3 tttp -119.58 127.62 53.14 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 120.978 0.418 . . . . 0.0 110.721 -179.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 5' ' ' LEU . . . . . 0.437 ' CD1' ' C ' ' X' ' 5' ' ' LEU . 1.0 OUTLIER -108.76 127.77 54.3 Favored 'General case' 0 N--CA 1.464 0.271 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 179.077 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' X' X ' 6' ' ' ILE . . . . . 0.406 ' N ' HD21 ' X' ' 5' ' ' LEU . 29.1 mm -98.12 132.57 42.81 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.46 0 CA-C-O 121.137 0.494 . . . . 0.0 110.006 -179.207 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 7' ' ' LEU . . . . . 0.538 ' CD1' ' HG1' ' X' ' 16' ' ' THR . 6.0 mp -91.65 115.26 27.9 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.443 -178.922 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 8' ' ' ASN . . . . . . . . . . . . . 21.4 t30 -134.28 86.95 2.31 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 108.045 -1.095 . . . . 0.0 108.045 177.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 9' ' ' GLY . . . . . 0.447 ' H ' ' HD3' ' X' ' 13' ' ' LYS . . . -125.97 -163.36 11.53 Favored Glycine 0 C--N 1.335 0.479 0 N-CA-C 111.506 -0.638 . . . . 0.0 111.506 -178.871 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 10' ' ' LYS . . . . . . . . . . . . . 57.8 mttt -76.97 -46.98 22.15 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.973 -0.291 . . . . 0.0 111.155 -179.655 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 11' ' ' THR . . . . . . . . . . . . . 42.1 p -130.57 18.33 5.26 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 -179.26 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 12' ' ' LEU . . . . . 0.726 ' N ' ' HZ3' ' X' ' 13' ' ' LYS . 0.3 OUTLIER -138.59 100.4 4.07 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 120.87 -0.332 . . . . 0.0 111.52 -179.632 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' X' X ' 13' ' ' LYS . . . . . 0.726 ' HZ3' ' N ' ' X' ' 12' ' ' LEU . 0.0 OUTLIER -122.21 137.56 54.79 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 178.895 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' X' X ' 14' ' ' GLY . . . . . 0.435 ' O ' ' OE1' ' X' ' 15' ' ' GLU . . . 173.44 -155.16 21.8 Favored Glycine 0 CA--C 1.534 1.271 0 N-CA-C 110.923 -0.871 . . . . 0.0 110.923 -179.902 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 15' ' ' GLU . . . . . 0.435 ' OE1' ' O ' ' X' ' 14' ' ' GLY . 5.1 mm-40 -134.73 150.64 50.6 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 110.061 -0.348 . . . . 0.0 110.061 179.615 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 16' ' ' THR . . . . . 0.538 ' HG1' ' CD1' ' X' ' 7' ' ' LEU . 1.9 m -148.08 129.67 14.99 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.301 178.926 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 17' ' ' THR . . . . . . . . . . . . . 2.3 m -129.41 157.21 42.6 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 120.98 0.419 . . . . 0.0 110.608 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 18' ' ' THR . . . . . . . . . . . . . 7.4 t -149.26 153.31 37.38 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.85 -179.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 19' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -103.81 105.67 15.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.218 -0.446 . . . . 0.0 109.847 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 20' ' ' ALA . . . . . . . . . . . . . . . -136.28 161.97 34.3 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.635 -179.695 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 21' ' ' VAL . . . . . . . . . . . . . 1.1 p -87.3 -40.79 14.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.44 179.345 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 22' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -104.75 155.78 18.58 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.402 -179.163 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 23' ' ' ALA . . . . . . . . . . . . . . . -75.09 -45.94 37.93 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.943 179.772 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 24' ' ' ALA . . . . . . . . . . . . . . . -62.88 -40.22 96.85 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.518 -179.059 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 25' ' ' THR . . . . . . . . . . . . . 1.2 t -63.28 -33.06 74.68 Favored 'General case' 0 C--N 1.346 0.432 0 O-C-N 122.016 -0.428 . . . . 0.0 110.716 -179.706 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.1 -35.84 78.8 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.88 0.371 . . . . 0.0 110.581 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 27' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -62.46 -28.57 69.91 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.509 -179.733 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 28' ' ' LYS . . . . . 0.418 ' O ' ' OE1' ' X' ' 32' ' ' GLN . 84.0 mttt -57.51 -43.88 84.6 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.255 -0.429 . . . . 0.0 109.885 -179.012 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 29' ' ' VAL . . . . . 0.441 ' O ' ' CB ' ' X' ' 33' ' ' TYR . 13.1 t -70.03 -50.27 49.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.498 179.366 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 30' ' ' PHE . . . . . . . . . . . . . 55.9 m-85 -61.67 -43.53 98.67 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.831 -179.363 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 31' ' ' LYS . . . . . . . . . . . . . 72.0 mttt -69.5 -42.14 75.13 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 120.352 -0.539 . . . . 0.0 110.49 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 32' ' ' GLN . . . . . 0.418 ' OE1' ' O ' ' X' ' 28' ' ' LYS . 79.6 mt-30 -73.21 -33.24 65.26 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.044 0.45 . . . . 0.0 109.954 179.371 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 33' ' ' TYR . . . . . 0.524 ' CZ ' ' OD1' ' X' ' 37' ' ' ASN . 65.9 t80 -68.31 -36.97 80.13 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.704 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.23 -38.51 80.15 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.43 -179.23 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 35' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -60.85 -48.09 83.4 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 109.835 -0.432 . . . . 0.0 109.835 179.39 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 36' ' ' ASP . . . . . 0.407 ' OD1' ' N ' ' X' ' 36' ' ' ASP . 1.6 m-20 -66.87 -24.44 66.12 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.977 179.554 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 37' ' ' ASN . . . . . 0.524 ' OD1' ' CZ ' ' X' ' 33' ' ' TYR . 1.0 OUTLIER -86.62 -26.81 24.21 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.082 -178.702 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' X' X ' 38' ' ' GLY . . . . . . . . . . . . . . . 106.48 -34.98 5.34 Favored Glycine 0 CA--C 1.532 1.146 0 C-N-CA 121.343 -0.456 . . . . 0.0 112.915 178.499 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 39' ' ' VAL . . . . . . . . . . . . . 2.1 p -80.4 107.88 13.23 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 CA-C-N 117.728 0.764 . . . . 0.0 110.873 -178.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 40' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -127.8 110.83 12.99 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 115.789 -0.642 . . . . 0.0 109.964 179.551 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 41' ' ' GLY . . . . . 0.45 ' H ' ' CG2' ' X' ' 54' ' ' VAL . . . -141.28 -155.39 6.46 Favored Glycine 0 CA--C 1.532 1.115 0 C-N-CA 120.763 -0.732 . . . . 0.0 111.769 -179.541 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 42' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -75.08 131.14 40.34 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 120.94 0.4 . . . . 0.0 110.202 -179.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 43' ' ' TRP . . . . . . . . . . . . . 83.6 m95 -97.38 161.42 13.8 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.651 0.739 . . . . 0.0 112.101 -178.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 44' ' ' THR . . . . . 0.5 ' CG2' ' OG1' ' X' ' 53' ' ' THR . 2.5 t -157.05 167.95 28.91 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.559 -1.2 . . . . 0.0 108.786 179.33 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 45' ' ' TYR . . . . . 0.635 ' CD1' ' CE1' ' X' ' 52' ' ' PHE . 22.1 t80 -170.56 134.23 1.08 Allowed 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 119.7 -0.8 . . . . 0.0 111.856 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 46' ' ' ASP . . . . . 0.416 ' OD2' ' OG1' ' X' ' 49' ' ' THR . 11.3 t0 -123.73 112.38 17.28 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 115.145 -0.934 . . . . 0.0 108.646 177.748 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 47' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -68.45 -16.39 63.88 Favored 'General case' 0 C--O 1.231 0.096 0 CA-C-O 120.716 0.294 . . . . 0.0 110.998 -179.419 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.35 -13.55 59.55 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.068 -179.748 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 49' ' ' THR . . . . . 0.416 ' OG1' ' OD2' ' X' ' 46' ' ' ASP . 2.6 p -128.19 2.95 5.79 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 110.647 -0.131 . . . . 0.0 110.647 -179.768 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 50' ' ' LYS . . . . . 0.599 ' NZ ' ' SD ' ' X' ' 1' ' ' MET . 64.2 mmtt 41.87 57.47 3.14 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 120.754 -0.378 . . . . 0.0 110.442 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 51' ' ' THR . . . . . . . . . . . . . 94.5 m -147.26 128.3 14.58 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 112.06 0.392 . . . . 0.0 112.06 -179.309 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 52' ' ' PHE . . . . . 0.635 ' CE1' ' CD1' ' X' ' 45' ' ' TYR . 29.2 m-85 -107.81 154.82 20.99 Favored 'General case' 0 C--N 1.343 0.325 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 178.561 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 53' ' ' THR . . . . . 0.5 ' OG1' ' CG2' ' X' ' 44' ' ' THR . 34.2 p -151.42 129.1 11.53 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 120.531 -0.467 . . . . 0.0 110.312 179.126 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 54' ' ' VAL . . . . . 0.45 ' CG2' ' H ' ' X' ' 41' ' ' GLY . 12.5 p -113.57 123.81 69.59 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.448 0 N-CA-C 109.381 -0.599 . . . . 0.0 109.381 179.01 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 55' ' ' THR . . . . . 0.457 ' CG2' ' O ' ' X' ' 55' ' ' THR . 5.3 t -125.45 120.3 30.62 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.399 -178.469 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 56' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 . . . . . 0 C--O 1.22 -0.481 0 CA-C-O 117.971 -1.014 . . . . 0.0 110.137 179.298 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' X' X ' 1' ' ' MET . . . . . 0.582 ' SD ' ' CE2' ' X' ' 3' ' ' TYR . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.705 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 . . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 2' ' ' GLN . . . . . . . . . . . . . 24.8 mt-30 -117.88 149.36 41.0 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 121.278 0.561 . . . . 0.0 111.659 -178.563 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 3' ' ' TYR . . . . . 0.582 ' CE2' ' SD ' ' X' ' 1' ' ' MET . 63.2 m-85 -123.39 143.98 49.77 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-N 115.287 -0.87 . . . . 0.0 108.769 178.93 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 4' ' ' LYS . . . . . . . . . . . . . 5.1 tttm -119.43 128.65 54.22 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 121.053 0.454 . . . . 0.0 111.118 -179.117 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 5' ' ' LEU . . . . . 0.444 ' CD1' ' C ' ' X' ' 5' ' ' LEU . 1.0 OUTLIER -108.93 128.27 54.78 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.283 179.697 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' X' X ' 6' ' ' ILE . . . . . 0.418 ' N ' HD23 ' X' ' 5' ' ' LEU . 26.5 mm -98.88 132.73 43.62 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.439 0 CA-C-O 121.043 0.449 . . . . 0.0 110.144 -179.272 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 7' ' ' LEU . . . . . . . . . . . . . 6.3 mp -92.09 108.78 20.19 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.36 -179.088 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 8' ' ' ASN . . . . . . . . . . . . . 11.9 t30 -131.2 87.72 2.51 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 178.621 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 9' ' ' GLY . . . . . 0.709 ' H ' ' HZ2' ' X' ' 13' ' ' LYS . . . -123.04 -147.4 7.36 Favored Glycine 0 N--CA 1.464 0.533 0 N-CA-C 111.505 -0.638 . . . . 0.0 111.505 -179.139 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 10' ' ' LYS . . . . . . . . . . . . . 48.5 mttt -77.78 -51.76 10.0 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 121.054 -0.258 . . . . 0.0 111.435 -179.453 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 11' ' ' THR . . . . . . . . . . . . . 41.5 p -130.53 -19.4 3.05 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 112.193 0.442 . . . . 0.0 112.193 -179.408 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 12' ' ' LEU . . . . . 0.682 ' N ' ' HZ1' ' X' ' 13' ' ' LYS . 0.6 OUTLIER -91.37 118.63 30.69 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 120.753 0.311 . . . . 0.0 111.165 -178.803 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' X' X ' 13' ' ' LYS . . . . . 0.709 ' HZ2' ' H ' ' X' ' 9' ' ' GLY . 0.1 OUTLIER -139.26 139.97 37.55 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 120.989 0.423 . . . . 0.0 110.434 179.65 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' X' X ' 14' ' ' GLY . . . . . . . . . . . . . . . 174.45 -154.72 19.65 Favored Glycine 0 CA--C 1.534 1.27 0 N-CA-C 110.871 -0.891 . . . . 0.0 110.871 -179.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 15' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -134.24 151.01 51.07 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 120.677 0.275 . . . . 0.0 110.297 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 2.7 m -147.68 129.43 15.17 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.027 178.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 17' ' ' THR . . . . . . . . . . . . . 2.0 m -130.77 158.57 39.78 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 120.903 0.382 . . . . 0.0 110.818 -179.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 18' ' ' THR . . . . . . . . . . . . . 6.3 t -154.25 153.29 31.48 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.463 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 19' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -103.85 113.12 26.41 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 179.653 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 20' ' ' ALA . . . . . . . . . . . . . . . -137.34 161.09 37.22 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.018 -179.544 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 21' ' ' VAL . . . . . . . . . . . . . 1.1 p -80.83 -39.82 18.3 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.335 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.58 179.331 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 22' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -116.94 156.79 26.81 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.999 -179.432 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.77 -41.31 60.29 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.962 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.18 -36.37 83.86 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.617 -179.126 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 25' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -70.23 -31.77 69.34 Favored 'General case' 0 C--N 1.345 0.384 0 O-C-N 122.091 -0.381 . . . . 0.0 110.795 -179.609 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.03 -35.52 78.4 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.974 0.416 . . . . 0.0 110.703 -179.825 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 27' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -57.61 -29.04 64.19 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.866 -179.565 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 28' ' ' LYS . . . . . . . . . . . . . 41.0 mtmt -56.0 -42.41 76.34 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 120.391 -0.524 . . . . 0.0 110.497 -178.685 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 29' ' ' VAL . . . . . . . . . . . . . 12.1 t -70.12 -51.16 41.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-O 120.889 0.376 . . . . 0.0 110.505 179.283 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 30' ' ' PHE . . . . . . . . . . . . . 60.2 m-85 -61.97 -42.43 99.12 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.971 -179.29 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 31' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -63.06 -51.31 67.17 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 120.738 -0.385 . . . . 0.0 111.075 -179.305 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 32' ' ' GLN . . . . . 0.408 ' O ' ' OD1' ' X' ' 36' ' ' ASP . 79.6 mt-30 -72.09 -32.86 67.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.139 -179.489 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 33' ' ' TYR . . . . . . . . . . . . . 29.1 t80 -60.9 -34.79 75.21 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.873 -179.406 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 34' ' ' ALA . . . . . 0.454 ' O ' ' OD1' ' X' ' 37' ' ' ASN . . . -59.9 -43.55 94.76 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.33 -179.414 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 35' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -66.84 -36.22 81.83 Favored 'General case' 0 N--CA 1.447 -0.621 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 179.4 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 36' ' ' ASP . . . . . 0.494 ' OD1' ' N ' ' X' ' 36' ' ' ASP . 0.7 OUTLIER -67.38 -31.05 71.02 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.893 -179.857 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' X' X ' 37' ' ' ASN . . . . . 0.583 HD22 ' CG1' ' X' ' 39' ' ' VAL . 15.8 p-10 -95.57 -24.58 16.54 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 111.951 0.352 . . . . 0.0 111.951 -178.528 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 38' ' ' GLY . . . . . 0.533 ' N ' ' OD1' ' X' ' 37' ' ' ASN . . . 121.24 -41.06 1.97 Allowed Glycine 0 CA--C 1.532 1.155 0 C-N-CA 121.308 -0.472 . . . . 0.0 113.514 177.957 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 39' ' ' VAL . . . . . 0.583 ' CG1' HD22 ' X' ' 37' ' ' ASN . 1.5 p -80.19 108.57 13.77 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.325 0 CA-C-N 117.735 0.767 . . . . 0.0 111.597 -178.149 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 40' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -127.74 111.54 13.79 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.881 179.084 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 41' ' ' GLY . . . . . 0.447 ' H ' ' CG2' ' X' ' 54' ' ' VAL . . . -141.48 -156.07 6.69 Favored Glycine 0 CA--C 1.534 1.232 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.077 -179.501 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 42' ' ' GLU . . . . . 0.531 ' CD ' ' H ' ' X' ' 42' ' ' GLU . 2.5 mp0 -75.14 139.12 42.5 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-O 120.743 0.306 . . . . 0.0 110.251 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 43' ' ' TRP . . . . . . . . . . . . . 81.3 m95 -103.86 163.47 12.33 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.866 0.841 . . . . 0.0 112.679 -178.262 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 44' ' ' THR . . . . . 0.48 ' CG2' ' OG1' ' X' ' 53' ' ' THR . 10.4 t -156.98 167.07 31.57 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 114.125 -1.398 . . . . 0.0 108.341 178.955 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 45' ' ' TYR . . . . . 0.623 ' CD1' ' CZ ' ' X' ' 52' ' ' PHE . 27.5 t80 -171.72 135.44 0.87 Allowed 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 119.603 -0.839 . . . . 0.0 111.858 -179.935 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 46' ' ' ASP . . . . . . . . . . . . . 11.7 t0 -123.29 112.44 17.63 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 177.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 47' ' ' ASP . . . . . . . . . . . . . 49.2 t0 -64.6 -15.67 61.5 Favored 'General case' 0 C--N 1.334 -0.076 0 CA-C-N 116.661 -0.245 . . . . 0.0 111.518 -179.143 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.99 -36.15 36.42 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 120.872 -0.331 . . . . 0.0 111.538 -179.494 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 49' ' ' THR . . . . . . . . . . . . . 2.8 p -102.84 2.91 36.04 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 110.632 -0.136 . . . . 0.0 110.632 -179.534 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 50' ' ' LYS . . . . . . . . . . . . . 14.0 mmmt 41.89 56.53 3.43 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 120.68 0.276 . . . . 0.0 110.412 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 51' ' ' THR . . . . . . . . . . . . . 39.0 m -144.32 129.49 18.67 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 -179.241 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 52' ' ' PHE . . . . . 0.623 ' CZ ' ' CD1' ' X' ' 45' ' ' TYR . 53.1 m-85 -108.31 153.77 22.76 Favored 'General case' 0 C--N 1.344 0.342 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 178.524 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 53' ' ' THR . . . . . 0.48 ' OG1' ' CG2' ' X' ' 44' ' ' THR . 65.9 p -151.23 130.12 12.47 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 120.522 -0.471 . . . . 0.0 110.476 179.185 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 54' ' ' VAL . . . . . 0.447 ' CG2' ' H ' ' X' ' 41' ' ' GLY . 11.2 p -113.53 123.98 69.72 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 179.21 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 55' ' ' THR . . . . . 0.448 ' CG2' ' O ' ' X' ' 55' ' ' THR . 4.2 t -125.34 120.68 31.81 Favored 'General case' 0 N--CA 1.474 0.725 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.351 -178.719 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 56' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 . . . . . 0 C--O 1.22 -0.463 0 CA-C-O 117.983 -1.008 . . . . 0.0 110.027 179.607 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' X' X ' 2' ' ' GLN . . . . . . . . . . . . . 29.7 mt-30 . . . . . 0 N--CA 1.466 0.368 0 CA-C-O 121.162 0.506 . . . . 0.0 111.072 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' X' X ' 3' ' ' TYR . . . . . 0.558 ' O ' HG23 ' X' ' 17' ' ' THR . 72.8 m-85 -115.66 143.1 45.84 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.447 179.341 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 4' ' ' LYS . . . . . . . . . . . . . 45.7 tttp -119.6 127.14 52.67 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 120.964 0.412 . . . . 0.0 110.331 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 5' ' ' LEU . . . . . 0.698 ' C ' HD13 ' X' ' 5' ' ' LEU . 1.0 OUTLIER -107.59 127.11 53.35 Favored 'General case' 0 N--CA 1.465 0.276 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 179.471 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' X' X ' 6' ' ' ILE . . . . . 0.535 ' N ' HD22 ' X' ' 5' ' ' LEU . 27.2 mm -98.43 132.91 42.59 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.493 0 CA-C-O 121.231 0.539 . . . . 0.0 109.78 -179.365 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 7' ' ' LEU . . . . . 0.453 HD23 HD22 ' X' ' 12' ' ' LEU . 6.0 mp -91.83 107.72 19.41 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.848 -178.617 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 8' ' ' ASN . . . . . 0.492 ' ND2' ' O ' ' X' ' 54' ' ' VAL . 1.7 p-10 -125.76 85.85 2.45 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 107.045 -1.465 . . . . 0.0 107.045 176.914 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 9' ' ' GLY . . . . . 0.69 ' C ' ' HZ1' ' X' ' 13' ' ' LYS . . . -116.06 -162.67 13.26 Favored Glycine 0 C--N 1.334 0.439 0 N-CA-C 111.271 -0.732 . . . . 0.0 111.271 -178.785 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 10' ' ' LYS . . . . . . . . . . . . . 48.1 mttt -66.67 -54.5 22.47 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 120.523 -0.471 . . . . 0.0 110.753 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 11' ' ' THR . . . . . . . . . . . . . 42.6 p -130.88 -8.78 3.94 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 120.692 0.282 . . . . 0.0 111.208 179.843 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 12' ' ' LEU . . . . . 0.496 ' O ' ' NZ ' ' X' ' 13' ' ' LYS . 0.6 OUTLIER -95.93 114.69 26.44 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.107 -178.713 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' X' X ' 13' ' ' LYS . . . . . 0.69 ' HZ1' ' C ' ' X' ' 9' ' ' GLY . 0.3 OUTLIER -135.54 142.56 45.4 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-O 120.942 0.401 . . . . 0.0 110.723 179.66 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' X' X ' 14' ' ' GLY . . . . . 0.432 ' O ' ' OE1' ' X' ' 15' ' ' GLU . . . 174.27 -158.03 26.22 Favored Glycine 0 CA--C 1.533 1.205 0 N-CA-C 110.937 -0.865 . . . . 0.0 110.937 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 15' ' ' GLU . . . . . 0.432 ' OE1' ' O ' ' X' ' 14' ' ' GLY . 5.0 mm-40 -134.17 150.88 51.12 Favored 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 110.139 -0.319 . . . . 0.0 110.139 179.689 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 2.3 m -148.02 129.43 14.83 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.278 178.91 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 17' ' ' THR . . . . . 0.558 HG23 ' O ' ' X' ' 3' ' ' TYR . 2.4 m -131.44 157.36 43.67 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 120.878 0.37 . . . . 0.0 110.546 179.835 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 18' ' ' THR . . . . . . . . . . . . . 7.5 t -149.52 152.96 36.44 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.019 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 19' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -103.93 105.81 16.12 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 179.924 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 20' ' ' ALA . . . . . . . . . . . . . . . -131.56 161.61 32.24 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 121.16 0.505 . . . . 0.0 111.235 -179.189 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 21' ' ' VAL . . . . . . . . . . . . . 1.2 p -87.02 -37.4 11.14 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.222 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.48 179.314 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 22' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -111.33 156.0 22.22 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.927 -179.416 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.99 -46.16 37.12 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.03 179.806 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 24' ' ' ALA . . . . . . . . . . . . . . . -62.41 -39.75 94.28 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.473 -179.011 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 25' ' ' THR . . . . . . . . . . . . . 1.1 t -64.14 -31.95 73.33 Favored 'General case' 0 C--N 1.345 0.393 0 C-N-CA 120.73 -0.388 . . . . 0.0 110.622 -179.609 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.03 -35.87 78.98 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.901 0.381 . . . . 0.0 110.651 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 27' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -61.76 -28.38 69.4 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.567 -179.775 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 28' ' ' LYS . . . . . . . . . . . . . 83.4 mttt -56.93 -43.1 81.12 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.178 -178.986 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 29' ' ' VAL . . . . . 0.427 ' O ' ' CB ' ' X' ' 33' ' ' TYR . 13.8 t -69.99 -51.19 42.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.533 179.298 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 30' ' ' PHE . . . . . . . . . . . . . 61.0 m-85 -61.91 -43.18 99.38 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.873 -179.301 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 31' ' ' LYS . . . . . . . . . . . . . 2.7 tppt? -66.34 -47.74 72.5 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 120.534 -0.466 . . . . 0.0 110.52 -179.785 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 32' ' ' GLN . . . . . . . . . . . . . 57.8 tp60 -71.81 -33.72 68.76 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.657 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 33' ' ' TYR . . . . . 0.427 ' CB ' ' O ' ' X' ' 29' ' ' VAL . 19.1 t80 -61.38 -30.52 70.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.478 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 34' ' ' ALA . . . . . 0.886 ' HB1' ' O ' ' X' ' 39' ' ' VAL . . . -59.32 -39.29 82.61 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.638 -178.6 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 35' ' ' ASN . . . . . . . . . . . . . 39.3 t-20 -69.06 -34.84 75.81 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 120.505 -0.478 . . . . 0.0 109.759 179.446 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 36' ' ' ASP . . . . . 0.508 ' N ' ' OD1' ' X' ' 36' ' ' ASP . 0.7 OUTLIER -67.28 -35.3 79.21 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 115.709 -0.678 . . . . 0.0 112.104 -179.538 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' X' X ' 37' ' ' ASN . . . . . 0.519 ' OD1' ' N ' ' X' ' 38' ' ' GLY . 24.6 p-10 -95.37 -25.17 16.39 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 120.86 -0.336 . . . . 0.0 111.512 -178.877 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 38' ' ' GLY . . . . . 0.519 ' N ' ' OD1' ' X' ' 37' ' ' ASN . . . 103.17 28.57 6.07 Favored Glycine 0 CA--C 1.534 1.238 0 CA-C-O 119.473 -0.626 . . . . 0.0 114.172 177.165 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 39' ' ' VAL . . . . . 0.886 ' O ' ' HB1' ' X' ' 34' ' ' ALA . 2.4 m -122.77 113.33 37.75 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 CA-C-N 118.201 1.001 . . . . 0.0 110.569 178.749 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 40' ' ' ASP . . . . . . . . . . . . . 19.0 t0 -127.35 108.01 10.48 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 179.799 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -145.19 -165.68 11.34 Favored Glycine 0 CA--C 1.531 1.065 0 N-CA-C 111.485 -0.646 . . . . 0.0 111.485 179.8 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 42' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -75.61 125.14 28.45 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 121.023 0.439 . . . . 0.0 110.429 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 43' ' ' TRP . . . . . . . . . . . . . 79.2 m95 -91.79 161.45 14.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.543 0.687 . . . . 0.0 111.59 -179.46 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 44' ' ' THR . . . . . 0.472 ' CG2' ' OG1' ' X' ' 53' ' ' THR . 9.1 t -156.91 167.57 30.08 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 114.617 -1.174 . . . . 0.0 108.497 179.162 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 45' ' ' TYR . . . . . 0.636 ' CD1' ' CE1' ' X' ' 52' ' ' PHE . 14.7 t80 -171.08 133.61 0.89 Allowed 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 119.458 -0.897 . . . . 0.0 112.062 -179.787 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 46' ' ' ASP . . . . . . . . . . . . . 12.7 t0 -123.95 112.39 17.15 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 177.627 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 47' ' ' ASP . . . . . 0.408 ' OD1' ' O ' ' X' ' 47' ' ' ASP . 10.1 t70 -67.19 -16.74 64.49 Favored 'General case' 0 C--O 1.231 0.106 0 CA-C-O 120.656 0.265 . . . . 0.0 110.997 -179.413 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.31 -12.97 59.93 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.138 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 49' ' ' THR . . . . . . . . . . . . . 2.6 p -128.16 2.93 5.81 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 110.526 -0.175 . . . . 0.0 110.526 -179.833 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 50' ' ' LYS . . . . . . . . . . . . . 68.5 mmtt 41.57 58.62 2.68 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 120.827 -0.349 . . . . 0.0 110.571 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 51' ' ' THR . . . . . . . . . . . . . 91.1 m -148.47 127.55 12.82 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 112.302 0.482 . . . . 0.0 112.302 -179.282 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 52' ' ' PHE . . . . . 0.636 ' CE1' ' CD1' ' X' ' 45' ' ' TYR . 19.4 m-85 -107.9 155.38 20.35 Favored 'General case' 0 C--N 1.344 0.357 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 178.318 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 53' ' ' THR . . . . . 0.472 ' OG1' ' CG2' ' X' ' 44' ' ' THR . 68.6 p -152.48 130.04 11.48 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 120.454 -0.498 . . . . 0.0 110.682 179.464 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 54' ' ' VAL . . . . . 0.503 ' O ' HG13 ' X' ' 54' ' ' VAL . 11.5 p -113.81 123.74 69.77 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 178.72 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 55' ' ' THR . . . . . 0.463 HG23 ' O ' ' X' ' 55' ' ' THR . 5.0 t -121.74 125.02 45.6 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.319 -178.412 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 56' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 . . . . . 0 C--O 1.22 -0.484 0 CA-C-O 117.955 -1.022 . . . . 0.0 110.348 179.765 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' X' X ' 2' ' ' GLN . . . . . . . . . . . . . 86.5 mt-30 . . . . . 0 N--CA 1.465 0.294 0 CA-C-O 121.006 0.431 . . . . 0.0 110.936 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' X' X ' 3' ' ' TYR . . . . . 0.54 ' O ' HG23 ' X' ' 17' ' ' THR . 60.6 m-85 -124.67 137.84 54.34 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.555 179.283 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 4' ' ' LYS . . . . . . . . . . . . . 10.0 ttmm -119.62 127.35 52.85 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 120.935 0.398 . . . . 0.0 110.303 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' X' X ' 5' ' ' LEU . . . . . 0.703 ' C ' HD13 ' X' ' 5' ' ' LEU . 1.0 OUTLIER -108.95 128.17 54.7 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 179.458 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' X' X ' 6' ' ' ILE . . . . . 0.547 ' N ' HD22 ' X' ' 5' ' ' LEU . 28.1 mm -98.45 132.12 44.2 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.485 0 CA-C-O 120.958 0.409 . . . . 0.0 109.954 -179.385 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 7' ' ' LEU . . . . . 0.408 ' HB2' ' H ' ' X' ' 14' ' ' GLY . 6.2 mp -92.16 112.54 24.51 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.246 -179.221 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 8' ' ' ASN . . . . . 0.558 ' N ' ' ND2' ' X' ' 8' ' ' ASN . 0.0 OUTLIER -132.58 87.51 2.42 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.199 -1.038 . . . . 0.0 108.199 178.214 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' X' X ' 9' ' ' GLY . . . . . 0.559 ' H ' ' NZ ' ' X' ' 13' ' ' LYS . . . -122.85 -158.01 10.09 Favored Glycine 0 C--N 1.335 0.523 0 N-CA-C 111.201 -0.759 . . . . 0.0 111.201 -178.905 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 10' ' ' LYS . . . . . . . . . . . . . 70.2 mttt -73.64 -47.42 40.19 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.785 -0.366 . . . . 0.0 111.239 -179.534 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' X' X ' 11' ' ' THR . . . . . . . . . . . . . 41.6 p -130.62 -15.8 3.47 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 -179.384 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' X' X ' 12' ' ' LEU . . . . . 0.635 ' C ' ' HZ3' ' X' ' 13' ' ' LYS . 0.4 OUTLIER -99.36 112.96 25.04 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 120.762 0.315 . . . . 0.0 111.449 -178.672 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' X' X ' 13' ' ' LYS . . . . . 0.635 ' HZ3' ' C ' ' X' ' 12' ' ' LEU . 0.3 OUTLIER -135.01 139.2 44.66 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.103 179.265 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' X' X ' 14' ' ' GLY . . . . . 0.408 ' H ' ' HB2' ' X' ' 7' ' ' LEU . . . 174.38 -154.75 19.82 Favored Glycine 0 CA--C 1.535 1.305 0 N-CA-C 110.861 -0.896 . . . . 0.0 110.861 -179.749 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 15' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -133.39 150.29 51.8 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 120.731 0.3 . . . . 0.0 110.446 179.845 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 2.8 m -148.06 129.42 14.78 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.328 178.927 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' X' X ' 17' ' ' THR . . . . . 0.54 HG23 ' O ' ' X' ' 3' ' ' TYR . 2.4 m -130.28 156.86 43.95 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 120.961 0.41 . . . . 0.0 110.728 179.794 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 18' ' ' THR . . . . . . . . . . . . . 7.5 t -148.97 153.3 37.74 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.86 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' X' X ' 19' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -103.93 105.63 15.88 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.217 -0.447 . . . . 0.0 109.88 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' X' X ' 20' ' ' ALA . . . . . . . . . . . . . . . -136.71 163.46 30.55 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.741 -179.639 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' X' X ' 21' ' ' VAL . . . . . 0.445 ' H ' HG12 ' X' ' 21' ' ' VAL . 1.1 p -89.81 -40.7 13.2 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.279 0 CA-C-N 115.883 -0.599 . . . . 0.0 109.389 179.291 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 22' ' ' ASP . . . . . . . . . . . . . 37.1 m-20 -103.69 155.11 18.83 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.413 -179.157 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' X' X ' 23' ' ' ALA . . . . . . . . . . . . . . . -75.16 -45.97 37.29 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.925 179.657 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' X' X ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.81 -39.87 95.26 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.454 -179.049 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' X' X ' 25' ' ' THR . . . . . . . . . . . . . 1.2 t -63.55 -34.06 76.96 Favored 'General case' 0 C--N 1.346 0.423 0 C-N-CA 120.617 -0.433 . . . . 0.0 110.607 -179.53 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' X' X ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.25 -35.86 78.57 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.945 0.403 . . . . 0.0 110.568 179.907 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' X' X ' 27' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -60.02 -29.32 68.42 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.812 -179.493 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 28' ' ' LYS . . . . . . . . . . . . . 41.2 mtmt -56.03 -41.97 75.8 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 120.416 -0.513 . . . . 0.0 110.416 -178.7 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' X' X ' 29' ' ' VAL . . . . . 0.428 ' O ' ' CB ' ' X' ' 33' ' ' TYR . 11.5 t -70.26 -51.71 36.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-O 120.984 0.421 . . . . 0.0 110.526 179.337 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 30' ' ' PHE . . . . . . . . . . . . . 57.6 m-85 -61.96 -42.9 99.64 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.986 -179.188 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' X' X ' 31' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -61.66 -51.25 69.22 Favored 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 120.494 -0.482 . . . . 0.0 110.73 -179.47 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 32' ' ' GLN . . . . . . . . . . . . . 45.0 tt0 -73.48 -35.93 65.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.285 -179.606 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' X' X ' 33' ' ' TYR . . . . . 0.428 ' CB ' ' O ' ' X' ' 29' ' ' VAL . 70.0 t80 -61.8 -46.1 91.0 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.552 -0.294 . . . . 0.0 111.09 -179.388 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 34' ' ' ALA . . . . . 0.477 ' HB1' ' O ' ' X' ' 39' ' ' VAL . . . -59.16 -41.37 88.21 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.609 -0.437 . . . . 0.0 110.049 -179.287 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 35' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -60.46 -43.5 96.84 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 178.701 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' X' X ' 36' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -66.99 -26.48 66.82 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.342 179.048 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' X' X ' 37' ' ' ASN . . . . . 0.469 HD21 ' HA ' ' X' ' 37' ' ' ASN . 0.1 OUTLIER -83.77 -25.89 30.1 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.867 -178.96 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' X' X ' 38' ' ' GLY . . . . . . . . . . . . . . . 114.8 -37.52 3.49 Favored Glycine 0 CA--C 1.531 1.038 0 C-N-CA 121.559 -0.353 . . . . 0.0 112.285 178.949 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' X' X ' 39' ' ' VAL . . . . . 0.477 ' O ' ' HB1' ' X' ' 34' ' ' ALA . 1.4 p -80.55 108.75 14.26 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.305 0 CA-C-N 117.333 0.567 . . . . 0.0 111.107 -179.123 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 40' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -127.28 110.89 13.3 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 115.846 -0.616 . . . . 0.0 109.816 179.325 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' X' X ' 41' ' ' GLY . . . . . 0.485 ' H ' ' CG2' ' X' ' 54' ' ' VAL . . . -141.37 -157.36 7.14 Favored Glycine 0 CA--C 1.533 1.174 0 C-N-CA 120.764 -0.731 . . . . 0.0 111.927 -179.485 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 42' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -75.12 133.05 41.61 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 120.877 0.37 . . . . 0.0 110.254 -179.777 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' X' X ' 43' ' ' TRP . . . . . . . . . . . . . 82.0 m95 -98.02 161.5 13.69 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.734 0.778 . . . . 0.0 112.078 -178.75 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' X' X ' 44' ' ' THR . . . . . 0.499 ' CG2' ' OG1' ' X' ' 53' ' ' THR . 2.5 t -157.07 169.1 25.58 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 114.348 -1.297 . . . . 0.0 108.818 179.381 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 45' ' ' TYR . . . . . 0.627 ' CD1' ' CE1' ' X' ' 52' ' ' PHE . 7.0 t80 -173.38 135.14 0.54 Allowed 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 119.801 -0.76 . . . . 0.0 111.7 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 46' ' ' ASP . . . . . 0.401 ' N ' ' CD1' ' X' ' 45' ' ' TYR . 8.5 t0 -123.56 112.42 17.43 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 115.269 -0.878 . . . . 0.0 108.648 177.955 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 47' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -66.51 -14.65 62.57 Favored 'General case' 0 C--N 1.334 -0.101 0 CA-C-O 120.825 0.345 . . . . 0.0 110.714 -179.547 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' X' X ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.82 -13.19 59.59 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.149 -179.885 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' X' X ' 49' ' ' THR . . . . . . . . . . . . . 3.0 p -129.03 4.29 5.31 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 112.138 0.421 . . . . 0.0 112.138 -178.977 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' X' X ' 50' ' ' LYS . . . . . . . . . . . . . 11.3 mmpt? 44.9 56.0 5.65 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 119.76 -0.776 . . . . 0.0 110.654 -179.694 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' X' X ' 51' ' ' THR . . . . . . . . . . . . . 36.6 m -149.91 130.0 13.55 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 112.519 0.563 . . . . 0.0 112.519 -179.015 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' X' X ' 52' ' ' PHE . . . . . 0.627 ' CE1' ' CD1' ' X' ' 45' ' ' TYR . 14.0 m-85 -110.89 154.3 24.25 Favored 'General case' 0 C--N 1.346 0.442 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 178.236 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 53' ' ' THR . . . . . 0.499 ' OG1' ' CG2' ' X' ' 44' ' ' THR . 47.5 p -150.95 131.14 13.54 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 120.333 -0.547 . . . . 0.0 110.472 179.151 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 54' ' ' VAL . . . . . 0.485 ' CG2' ' H ' ' X' ' 41' ' ' GLY . 10.8 p -113.48 124.31 69.99 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 179.176 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 55' ' ' THR . . . . . 0.532 HG23 ' O ' ' X' ' 55' ' ' THR . 4.7 t -124.82 120.99 33.28 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 116.4 -0.363 . . . . 0.0 111.445 -178.594 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 56' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 . . . . . 0 C--O 1.22 -0.459 0 CA-C-O 117.917 -1.04 . . . . 0.0 110.208 179.389 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' X' X ' 2' ' ' GLN . . . . . . . . . . . . . 92.7 mt-30 . . . . . 0 N--CA 1.464 0.241 0 CA-C-O 120.998 0.427 . . . . 0.0 111.177 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' X' X ' 3' ' ' TYR . . . . . 0.451 ' O ' HG23 ' X' ' 17' ' ' THR . 64.5 m-85 -115.99 141.22 48.41 Favored 'General case' 0 CA--C 1.517 -0.308 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 178.733 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 4' ' ' LYS . . . . . . . . . . . . . 49.8 tttp -119.47 127.28 52.92 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 120.767 0.317 . . . . 0.0 110.34 -179.831 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' X' X ' 5' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -103.32 130.01 50.49 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.109 179.809 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 6' ' ' ILE . . . . . . . . . . . . . 32.6 mm -101.17 127.3 54.55 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.485 0 N-CA-C 109.349 -0.612 . . . . 0.0 109.349 178.07 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' X' X ' 7' ' ' LEU . . . . . 0.493 HD23 HD22 ' X' ' 12' ' ' LEU . 6.3 mp -93.45 112.11 23.93 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.502 -178.841 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 8' ' ' ASN . . . . . 0.558 ' OD1' ' N ' ' X' ' 8' ' ' ASN . 1.9 p-10 -134.59 87.61 2.37 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 178.237 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 9' ' ' GLY . . . . . 0.599 ' H ' ' NZ ' ' X' ' 13' ' ' LYS . . . -125.76 -157.4 9.6 Favored Glycine 0 C--N 1.336 0.543 0 N-CA-C 111.404 -0.678 . . . . 0.0 111.404 -178.971 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 10' ' ' LYS . . . . . . . . . . . . . 70.8 mttt -79.97 -49.18 12.21 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 121.059 -0.256 . . . . 0.0 111.543 -179.248 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' X' X ' 11' ' ' THR . . . . . . . . . . . . . 42.5 p -130.2 18.46 5.44 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -179.031 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' X' X ' 12' ' ' LEU . . . . . 0.794 ' H ' ' HZ1' ' X' ' 13' ' ' LYS . 0.4 OUTLIER -138.41 106.34 5.68 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 120.803 0.335 . . . . 0.0 110.905 -179.699 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' X' X ' 13' ' ' LYS . . . . . 0.794 ' HZ1' ' H ' ' X' ' 12' ' ' LEU . 0.2 OUTLIER -130.78 138.94 50.16 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.273 179.509 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' X' X ' 14' ' ' GLY . . . . . 0.427 ' O ' ' OE2' ' X' ' 15' ' ' GLU . . . 173.87 -155.4 21.79 Favored Glycine 0 CA--C 1.533 1.183 0 N-CA-C 111.158 -0.777 . . . . 0.0 111.158 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 15' ' ' GLU . . . . . 0.427 ' OE2' ' O ' ' X' ' 14' ' ' GLY . 6.6 mm-40 -134.11 151.98 51.63 Favored 'General case' 0 N--CA 1.465 0.291 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 179.609 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -147.75 141.67 25.85 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 179.142 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 17' ' ' THR . . . . . 0.451 HG23 ' O ' ' X' ' 3' ' ' TYR . 2.6 m -144.4 154.55 43.1 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 121.19 0.519 . . . . 0.0 110.978 179.651 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 18' ' ' THR . . . . . 0.52 HG22 ' CZ ' ' X' ' 30' ' ' PHE . 14.6 t -155.45 153.58 30.55 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.411 -179.845 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 19' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -103.65 105.61 15.89 Favored 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 179.791 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' X' X ' 20' ' ' ALA . . . . . . . . . . . . . . . -126.98 160.45 31.03 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.798 -179.678 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' X' X ' 21' ' ' VAL . . . . . 0.466 ' H ' HG12 ' X' ' 21' ' ' VAL . 1.0 OUTLIER -80.77 -41.4 19.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 N-CA-C 109.29 -0.634 . . . . 0.0 109.29 179.277 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' X' X ' 22' ' ' ASP . . . . . 0.42 ' OD1' ' N ' ' X' ' 22' ' ' ASP . 32.1 p-10 -127.99 161.47 29.08 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.573 -179.774 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.2 -35.19 63.93 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.028 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' X' X ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.63 -37.65 76.37 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.91 -178.794 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' X' X ' 25' ' ' THR . . . . . 0.402 ' CG2' ' OD1' ' X' ' 22' ' ' ASP . 1.5 t -75.23 -40.19 59.25 Favored 'General case' 0 C--N 1.345 0.376 0 CA-C-N 118.129 0.422 . . . . 0.0 111.239 -179.337 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.93 -35.58 78.67 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.849 0.356 . . . . 0.0 111.162 -179.448 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' X' X ' 27' ' ' GLU . . . . . 0.435 ' O ' ' CB ' ' X' ' 31' ' ' LYS . 1.6 pt-20 -59.59 -30.46 68.69 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.237 -179.235 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 28' ' ' LYS . . . . . . . . . . . . . 81.7 mttt -58.07 -48.83 78.93 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.307 -0.557 . . . . 0.0 110.326 -178.425 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' X' X ' 29' ' ' VAL . . . . . 0.43 ' O ' ' CB ' ' X' ' 33' ' ' TYR . 12.4 t -72.55 -51.72 27.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-O 121.189 0.518 . . . . 0.0 110.795 179.24 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 30' ' ' PHE . . . . . 0.52 ' CZ ' HG22 ' X' ' 18' ' ' THR . 4.6 m-30 -61.48 -43.18 99.33 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.828 -178.672 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 31' ' ' LYS . . . . . 0.435 ' CB ' ' O ' ' X' ' 27' ' ' GLU . 14.9 ttmt -66.65 -46.98 73.99 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.218 -0.593 . . . . 0.0 110.575 -179.892 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 32' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -73.49 -32.86 64.51 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.118 -179.862 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' X' X ' 33' ' ' TYR . . . . . 0.43 ' CB ' ' O ' ' X' ' 29' ' ' VAL . 58.1 t80 -60.66 -46.09 91.63 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.141 -178.922 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 34' ' ' ALA . . . . . 0.584 ' HB1' ' O ' ' X' ' 39' ' ' VAL . . . -60.17 -36.42 77.55 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.649 -0.421 . . . . 0.0 110.171 -179.733 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 35' ' ' ASN . . . . . . . . . . . . . 5.7 t30 -71.18 -44.49 65.35 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 179.416 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' X' X ' 36' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -67.39 -32.77 73.9 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.827 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' X' X ' 37' ' ' ASN . . . . . 0.563 ' OD1' ' N ' ' X' ' 38' ' ' GLY . 24.5 p30 -79.23 -24.3 43.16 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 120.474 -0.49 . . . . 0.0 111.328 -178.832 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 38' ' ' GLY . . . . . 0.563 ' N ' ' OD1' ' X' ' 37' ' ' ASN . . . 130.87 -44.41 1.21 Allowed Glycine 0 CA--C 1.532 1.134 0 C-N-CA 121.257 -0.497 . . . . 0.0 112.738 178.601 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 39' ' ' VAL . . . . . 0.584 ' O ' ' HB1' ' X' ' 34' ' ' ALA . 1.9 p -81.0 109.08 14.98 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 CA-C-N 117.403 0.601 . . . . 0.0 112.089 -178.114 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 40' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -128.19 111.02 12.98 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.49 178.813 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' X' X ' 41' ' ' GLY . . . . . 0.449 ' H ' ' CG2' ' X' ' 54' ' ' VAL . . . -143.52 -155.24 6.36 Favored Glycine 0 CA--C 1.533 1.202 0 C-N-CA 120.291 -0.957 . . . . 0.0 112.471 -179.298 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 42' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -74.37 141.64 45.13 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 -179.856 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' X' X ' 43' ' ' TRP . . . . . . . . . . . . . 83.6 m95 -104.99 162.37 13.41 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.897 0.856 . . . . 0.0 112.858 -177.829 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' X' X ' 44' ' ' THR . . . . . 0.498 ' CG2' ' OG1' ' X' ' 53' ' ' THR . 2.5 t -157.01 164.21 38.24 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 114.073 -1.421 . . . . 0.0 108.828 179.339 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 45' ' ' TYR . . . . . 0.62 ' CD1' ' CE1' ' X' ' 52' ' ' PHE . 3.0 t80 -175.03 134.53 0.34 Allowed 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 119.701 -0.8 . . . . 0.0 111.666 179.862 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 46' ' ' ASP . . . . . 0.514 ' N ' ' CD1' ' X' ' 45' ' ' TYR . 11.2 t0 -123.74 112.56 17.49 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 115.186 -0.916 . . . . 0.0 108.699 177.978 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 47' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -65.81 -15.63 63.06 Favored 'General case' 0 C--O 1.231 0.079 0 CA-C-O 120.698 0.285 . . . . 0.0 110.918 -179.674 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' X' X ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.33 -13.67 59.49 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.069 -179.729 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' X' X ' 49' ' ' THR . . . . . . . . . . . . . 2.7 p -128.29 3.14 5.73 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 121.436 -0.106 . . . . 0.0 110.725 -179.657 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' X' X ' 50' ' ' LYS . . . . . . . . . . . . . 68.6 mmtt 41.18 56.39 3.07 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 120.839 -0.344 . . . . 0.0 110.632 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' X' X ' 51' ' ' THR . . . . . . . . . . . . . 96.8 m -144.16 127.02 16.29 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 120.671 0.272 . . . . 0.0 111.456 -179.409 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' X' X ' 52' ' ' PHE . . . . . 0.62 ' CE1' ' CD1' ' X' ' 45' ' ' TYR . 15.9 m-85 -109.44 153.93 23.34 Favored 'General case' 0 C--N 1.343 0.295 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 179.109 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 53' ' ' THR . . . . . 0.498 ' OG1' ' CG2' ' X' ' 44' ' ' THR . 4.3 p -152.23 129.3 11.09 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 120.493 -0.483 . . . . 0.0 109.989 178.82 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 54' ' ' VAL . . . . . 0.473 ' O ' HG13 ' X' ' 54' ' ' VAL . 14.4 p -112.84 124.2 69.25 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 178.48 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 55' ' ' THR . . . . . 0.431 ' O ' HG23 ' X' ' 55' ' ' THR . 2.0 t -124.55 124.49 42.38 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.651 -178.085 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 56' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 . . . . . 0 C--O 1.221 -0.402 0 CA-C-O 117.968 -1.015 . . . . 0.0 110.09 179.465 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' X' X ' 2' ' ' GLN . . . . . . . . . . . . . 16.0 pt20 . . . . . 0 N--CA 1.465 0.304 0 CA-C-O 120.879 0.371 . . . . 0.0 110.756 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' X' X ' 3' ' ' TYR . . . . . 0.537 ' O ' HG23 ' X' ' 17' ' ' THR . 92.0 m-85 -115.81 148.44 39.89 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.9 -0.591 . . . . 0.0 109.627 179.379 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 4' ' ' LYS . . . . . . . . . . . . . 45.5 tttp -119.27 127.81 53.58 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 120.927 0.394 . . . . 0.0 110.259 179.842 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' X' X ' 5' ' ' LEU . . . . . 0.706 ' C ' HD13 ' X' ' 5' ' ' LEU . 1.1 tm? -109.72 127.83 54.86 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.403 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 6' ' ' ILE . . . . . 0.518 ' N ' HD22 ' X' ' 5' ' ' LEU . 26.8 mm -98.91 132.34 44.41 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.349 0 CA-C-O 120.901 0.381 . . . . 0.0 110.15 -179.361 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 7' ' ' LEU . . . . . 0.435 HD21 HD22 ' X' ' 37' ' ' ASN . 6.3 mp -92.42 110.75 22.16 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.649 -179.131 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 8' ' ' ASN . . . . . 0.469 ' OD1' ' N ' ' X' ' 8' ' ' ASN . 6.3 p-10 -134.57 87.68 2.37 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 178.034 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 9' ' ' GLY . . . . . 0.821 ' H ' ' HZ1' ' X' ' 13' ' ' LYS . . . -123.89 -143.5 6.26 Favored Glycine 0 N--CA 1.464 0.552 0 N-CA-C 111.662 -0.575 . . . . 0.0 111.662 -179.158 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 10' ' ' LYS . . . . . . . . . . . . . 74.1 mttt -87.98 -53.17 4.87 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 111.818 0.303 . . . . 0.0 111.818 -179.274 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' X' X ' 11' ' ' THR . . . . . . . . . . . . . 41.4 p -130.29 21.83 5.23 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 -178.907 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' X' X ' 12' ' ' LEU . . . . . 0.777 ' C ' ' HZ2' ' X' ' 13' ' ' LYS . 0.6 OUTLIER -138.56 116.98 12.0 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 120.707 0.289 . . . . 0.0 110.725 -179.95 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' X' X ' 13' ' ' LYS . . . . . 0.821 ' HZ1' ' H ' ' X' ' 9' ' ' GLY . 0.3 OUTLIER -138.88 139.72 38.17 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.009 0.433 . . . . 0.0 110.749 179.889 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' X' X ' 14' ' ' GLY . . . . . 0.439 ' O ' ' OE1' ' X' ' 15' ' ' GLU . . . 174.17 -155.24 21.15 Favored Glycine 0 CA--C 1.533 1.17 0 N-CA-C 110.624 -0.991 . . . . 0.0 110.624 -179.913 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 15' ' ' GLU . . . . . 0.439 ' OE1' ' O ' ' X' ' 14' ' ' GLY . 5.2 mm-40 -133.83 150.87 51.42 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.863 0.332 . . . . 0.0 110.166 179.684 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 2.8 m -147.9 129.22 14.77 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 120.776 -0.37 . . . . 0.0 110.159 179.006 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' X' X ' 17' ' ' THR . . . . . 0.537 HG23 ' O ' ' X' ' 3' ' ' TYR . 2.5 m -130.69 156.79 44.33 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 120.989 0.423 . . . . 0.0 110.544 179.895 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 18' ' ' THR . . . . . . . . . . . . . 7.6 t -148.91 152.88 37.17 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 115.881 -0.599 . . . . 0.0 109.545 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' X' X ' 19' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -104.21 105.55 15.73 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 -179.679 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' X' X ' 20' ' ' ALA . . . . . . . . . . . . . . . -136.66 163.12 31.32 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.69 -179.579 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' X' X ' 21' ' ' VAL . . . . . 0.453 ' H ' HG12 ' X' ' 21' ' ' VAL . 1.1 p -88.56 -40.78 13.69 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.595 179.26 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 22' ' ' ASP . . . . . 0.426 ' OD1' ' N ' ' X' ' 23' ' ' ALA . 46.5 t0 -103.61 154.41 19.53 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.376 -179.247 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 23' ' ' ALA . . . . . 0.426 ' N ' ' OD1' ' X' ' 22' ' ' ASP . . . -75.08 -43.35 53.61 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.87 179.599 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.34 -39.79 94.59 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.595 -179.148 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' X' X ' 25' ' ' THR . . . . . . . . . . . . . 1.2 t -64.11 -34.2 77.51 Favored 'General case' 0 C--N 1.345 0.405 0 C-N-CA 120.665 -0.414 . . . . 0.0 110.572 -179.732 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' X' X ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.43 -35.88 78.26 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.877 0.37 . . . . 0.0 110.777 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' X' X ' 27' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -61.58 -28.02 69.05 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.859 -179.6 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' X' X ' 28' ' ' LYS . . . . . . . . . . . . . 83.8 mttt -56.8 -44.27 81.77 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.535 -0.466 . . . . 0.0 110.003 -179.025 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' X' X ' 29' ' ' VAL . . . . . 0.429 ' O ' ' CB ' ' X' ' 33' ' ' TYR . 11.5 t -70.15 -50.92 43.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.647 179.289 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 30' ' ' PHE . . . . . . . . . . . . . 55.0 m-85 -61.8 -43.53 98.67 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.111 -0.495 . . . . 0.0 112.009 -179.019 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' X' X ' 31' ' ' LYS . . . . . . . . . . . . . 67.5 mttt -70.47 -40.94 73.37 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 120.215 -0.594 . . . . 0.0 110.386 -179.627 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' X' X ' 32' ' ' GLN . . . . . . . . . . . . . 3.6 tp-100 -73.17 -33.55 65.52 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 179.168 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' X' X ' 33' ' ' TYR . . . . . 0.429 ' CB ' ' O ' ' X' ' 29' ' ' VAL . 29.2 t80 -66.76 -36.83 83.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.877 -179.848 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 34' ' ' ALA . . . . . 0.509 ' HB1' ' O ' ' X' ' 39' ' ' VAL . . . -59.38 -41.83 90.28 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.492 -179.188 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 35' ' ' ASN . . . . . . . . . . . . . 13.3 t-20 -66.67 -37.68 85.27 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 179.209 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' X' X ' 36' ' ' ASP . . . . . 0.491 ' N ' ' OD1' ' X' ' 36' ' ' ASP . 0.9 OUTLIER -67.71 -33.15 74.31 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.404 -0.816 . . . . 0.0 111.938 -179.908 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' X' X ' 37' ' ' ASN . . . . . 0.605 HD21 ' CG1' ' X' ' 39' ' ' VAL . 14.8 p-10 -90.59 -24.57 20.52 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 120.766 -0.374 . . . . 0.0 111.883 -178.301 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 38' ' ' GLY . . . . . 0.535 ' N ' ' OD1' ' X' ' 37' ' ' ASN . . . 118.92 -39.2 2.61 Favored Glycine 0 CA--C 1.533 1.2 0 C-N-CA 121.228 -0.51 . . . . 0.0 113.806 177.752 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 39' ' ' VAL . . . . . 0.605 ' CG1' HD21 ' X' ' 37' ' ' ASN . 1.5 p -80.24 108.29 13.51 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 CA-C-N 117.974 0.887 . . . . 0.0 111.549 -178.042 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 40' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -127.78 111.94 14.21 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 115.762 -0.654 . . . . 0.0 109.861 179.143 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' X' X ' 41' ' ' GLY . . . . . 0.524 ' H ' ' CG2' ' X' ' 54' ' ' VAL . . . -141.82 -154.96 6.3 Favored Glycine 0 CA--C 1.534 1.223 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.149 -179.464 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 42' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -74.98 137.34 41.5 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 110.092 -0.336 . . . . 0.0 110.092 -179.789 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' X' X ' 43' ' ' TRP . . . . . . . . . . . . . 82.1 m95 -102.97 161.88 13.39 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.767 0.794 . . . . 0.0 112.611 -178.45 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' X' X ' 44' ' ' THR . . . . . 0.481 ' CG2' ' OG1' ' X' ' 53' ' ' THR . 11.3 t -157.01 169.04 25.74 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.181 -1.372 . . . . 0.0 108.368 179.251 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 45' ' ' TYR . . . . . 0.612 ' CD1' ' CE1' ' X' ' 52' ' ' PHE . 3.0 t80 -174.43 135.27 0.42 Allowed 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 119.597 -0.841 . . . . 0.0 111.819 -179.951 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 46' ' ' ASP . . . . . 0.517 ' N ' ' CD1' ' X' ' 45' ' ' TYR . 14.8 t0 -123.68 112.5 17.46 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 115.206 -0.907 . . . . 0.0 108.804 177.989 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 47' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -66.56 -14.94 63.01 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-O 120.775 0.321 . . . . 0.0 110.831 -179.789 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' X' X ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.34 -14.53 58.92 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.082 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' X' X ' 49' ' ' THR . . . . . . . . . . . . . 2.7 p -128.27 3.33 5.74 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 121.475 -0.09 . . . . 0.0 110.888 -179.737 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' X' X ' 50' ' ' LYS . . . . . . . . . . . . . 68.7 mmtt 41.63 56.7 3.25 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 120.799 -0.36 . . . . 0.0 110.546 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' X' X ' 51' ' ' THR . . . . . . . . . . . . . 86.3 m -146.24 127.84 15.15 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 120.775 0.322 . . . . 0.0 111.828 -179.303 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' X' X ' 52' ' ' PHE . . . . . 0.612 ' CE1' ' CD1' ' X' ' 45' ' ' TYR . 11.0 m-85 -108.2 155.29 20.62 Favored 'General case' 0 C--N 1.343 0.301 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 178.725 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 53' ' ' THR . . . . . 0.481 ' OG1' ' CG2' ' X' ' 44' ' ' THR . 58.8 p -150.97 130.54 13.02 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 120.513 -0.475 . . . . 0.0 110.396 179.277 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 54' ' ' VAL . . . . . 0.524 ' CG2' ' H ' ' X' ' 41' ' ' GLY . 11.4 p -113.58 123.89 69.68 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.408 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 179.243 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 55' ' ' THR . . . . . 0.52 HG23 ' O ' ' X' ' 55' ' ' THR . 4.2 t -125.31 120.39 31.03 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.403 -178.715 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 56' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 . . . . . 0 C--O 1.219 -0.517 0 CA-C-O 118.117 -0.944 . . . . 0.0 110.094 179.567 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' X' X ' 2' ' ' GLN . . . . . . . . . . . . . 80.0 mt-30 . . . . . 0 N--CA 1.467 0.402 0 CA-C-O 120.961 0.41 . . . . 0.0 111.312 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' X' X ' 3' ' ' TYR . . . . . 0.636 ' CD1' ' N ' ' X' ' 3' ' ' TYR . 0.1 OUTLIER -119.87 168.74 10.81 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 178.866 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' X' X ' 4' ' ' LYS . . . . . . . . . . . . . 28.7 tttm -135.86 128.78 31.29 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 121.062 -0.255 . . . . 0.0 110.566 -179.829 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' X' X ' 5' ' ' LEU . . . . . 0.573 HD22 ' N ' ' X' ' 6' ' ' ILE . 1.7 tm? -105.79 126.26 51.96 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 179.633 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 6' ' ' ILE . . . . . 0.573 ' N ' HD22 ' X' ' 5' ' ' LEU . 32.9 mm -98.14 132.54 42.91 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.452 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 179.393 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 7' ' ' LEU . . . . . 0.502 HD23 HD22 ' X' ' 12' ' ' LEU . 5.7 mp -92.21 115.25 27.92 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.652 -179.536 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 8' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 -134.55 87.52 2.36 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 177.863 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' X' X ' 9' ' ' GLY . . . . . 0.529 ' H ' ' HD3' ' X' ' 13' ' ' LYS . . . -126.85 -163.0 11.37 Favored Glycine 0 C--N 1.336 0.541 0 N-CA-C 111.291 -0.724 . . . . 0.0 111.291 -179.096 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 10' ' ' LYS . . . . . . . . . . . . . 40.5 mtmt -80.55 -43.02 21.34 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.938 -0.305 . . . . 0.0 110.937 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' X' X ' 11' ' ' THR . . . . . . . . . . . . . 42.3 p -130.54 15.78 5.43 Favored 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 112.3 0.482 . . . . 0.0 112.3 -179.195 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' X' X ' 12' ' ' LEU . . . . . 0.664 ' N ' ' HZ2' ' X' ' 13' ' ' LYS . 0.3 OUTLIER -138.52 100.44 4.09 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 120.842 -0.343 . . . . 0.0 111.642 -179.526 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' X' X ' 13' ' ' LYS . . . . . 0.664 ' HZ2' ' N ' ' X' ' 12' ' ' LEU . 0.0 OUTLIER -122.44 137.77 54.76 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 178.829 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' X' X ' 14' ' ' GLY . . . . . . . . . . . . . . . 173.17 -154.6 20.85 Favored Glycine 0 CA--C 1.533 1.184 0 N-CA-C 111.082 -0.807 . . . . 0.0 111.082 -179.73 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' X' X ' 15' ' ' GLU . . . . . . . . . . . . . 56.8 mm-40 -131.8 152.74 50.76 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.595 0.236 . . . . 0.0 110.469 179.613 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -148.23 154.85 40.62 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 120.969 0.414 . . . . 0.0 110.441 179.716 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 17' ' ' THR . . . . . 0.594 HG23 ' O ' ' X' ' 3' ' ' TYR . 2.0 m -145.96 158.93 43.86 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.737 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 18' ' ' THR . . . . . . . . . . . . . 4.4 t -153.08 151.2 29.94 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-N 116.203 -0.453 . . . . 0.0 109.885 179.069 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' X' X ' 19' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -106.55 110.81 23.12 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.089 179.769 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 20' ' ' ALA . . . . . . . . . . . . . . . -147.57 162.12 39.75 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.055 0.455 . . . . 0.0 110.597 179.766 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' X' X ' 21' ' ' VAL . . . . . 0.448 HG12 ' H ' ' X' ' 21' ' ' VAL . 1.1 p -87.0 -41.38 14.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.717 179.561 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 22' ' ' ASP . . . . . . . . . . . . . 68.6 m-20 -103.86 151.82 22.66 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.482 -179.033 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' X' X ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.43 -37.46 63.31 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.298 -0.864 . . . . 0.0 110.872 179.735 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' X' X ' 24' ' ' ALA . . . . . . . . . . . . . . . -70.49 -38.23 74.33 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.332 -179.197 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' X' X ' 25' ' ' THR . . . . . . . . . . . . . 1.1 t -67.29 -29.82 69.52 Favored 'General case' 0 C--N 1.345 0.408 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.621 -179.835 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' X' X ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.55 -35.77 79.69 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.495 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' X' X ' 27' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -58.31 -30.4 66.63 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.579 -179.771 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' X' X ' 28' ' ' LYS . . . . . . . . . . . . . 41.7 mtmt -57.34 -39.52 76.09 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.472 -0.491 . . . . 0.0 110.181 -178.948 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' X' X ' 29' ' ' VAL . . . . . 0.415 ' O ' ' CB ' ' X' ' 33' ' ' TYR . 13.0 t -70.02 -51.47 39.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.543 179.33 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 30' ' ' PHE . . . . . . . . . . . . . 40.8 m-85 -64.59 -42.97 95.25 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.859 -179.412 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' X' X ' 31' ' ' LYS . . . . . . . . . . . . . 2.8 tppt? -61.46 -49.2 77.75 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 120.282 -0.567 . . . . 0.0 110.78 -179.478 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' X' X ' 32' ' ' GLN . . . . . . . . . . . . . 89.6 mt-30 -73.08 -38.36 66.44 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.838 -179.746 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' X' X ' 33' ' ' TYR . . . . . 0.676 ' CZ ' ' ND2' ' X' ' 37' ' ' ASN . 69.8 t80 -61.8 -37.47 84.51 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.645 -179.797 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 34' ' ' ALA . . . . . 0.474 ' HB1' ' O ' ' X' ' 39' ' ' VAL . . . -59.27 -38.06 79.17 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.39 -179.325 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 35' ' ' ASN . . . . . . . . . . . . . 10.0 m-20 -61.18 -48.17 82.78 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 179.504 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' X' X ' 36' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -66.81 -24.7 66.2 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.02 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' X' X ' 37' ' ' ASN . . . . . 0.676 ' ND2' ' CZ ' ' X' ' 33' ' ' TYR . 0.5 OUTLIER -87.27 -26.08 23.63 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 116.471 -0.332 . . . . 0.0 110.996 -178.943 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' X' X ' 38' ' ' GLY . . . . . . . . . . . . . . . 106.08 -36.91 4.1 Favored Glycine 0 CA--C 1.53 1.019 0 C-N-CA 121.359 -0.448 . . . . 0.0 112.563 178.626 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' X' X ' 39' ' ' VAL . . . . . 0.474 ' O ' ' HB1' ' X' ' 34' ' ' ALA . 3.1 p -79.96 107.74 12.68 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.39 0 CA-C-N 117.575 0.687 . . . . 0.0 110.983 -179.096 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 40' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -128.12 110.83 12.83 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.888 179.358 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' X' X ' 41' ' ' GLY . . . . . 0.513 ' H ' ' CG2' ' X' ' 54' ' ' VAL . . . -141.86 -155.72 6.56 Favored Glycine 0 CA--C 1.531 1.064 0 C-N-CA 120.683 -0.77 . . . . 0.0 111.943 -179.69 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 42' ' ' GLU . . . . . . . . . . . . . 10.9 mt-10 -74.99 133.62 41.65 Favored 'General case' 0 N--CA 1.446 -0.631 0 N-CA-C 110.129 -0.323 . . . . 0.0 110.129 -179.803 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' X' X ' 43' ' ' TRP . . . . . . . . . . . . . 90.6 m95 -99.19 162.36 13.1 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.476 0.655 . . . . 0.0 111.892 -178.541 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' X' X ' 44' ' ' THR . . . . . 0.507 ' CG2' ' OG1' ' X' ' 53' ' ' THR . 2.5 t -156.9 167.11 31.46 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 114.845 -1.071 . . . . 0.0 109.492 179.783 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 45' ' ' TYR . . . . . 0.63 ' CD1' ' CZ ' ' X' ' 52' ' ' PHE . 64.7 t80 -166.52 136.7 3.24 Favored 'General case' 0 CA--C 1.519 -0.241 0 C-N-CA 120.116 -0.634 . . . . 0.0 111.958 179.739 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 46' ' ' ASP . . . . . . . . . . . . . 18.8 t0 -123.44 111.79 16.76 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 177.523 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' X' X ' 47' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -67.11 -15.74 63.9 Favored 'General case' 0 C--O 1.231 0.095 0 CA-C-O 120.882 0.372 . . . . 0.0 110.751 -179.708 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' X' X ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.35 -18.09 53.17 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.115 -179.698 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' X' X ' 49' ' ' THR . . . . . . . . . . . . . 2.6 p -128.2 2.74 5.79 Favored 'General case' 0 N--CA 1.469 0.521 0 N-CA-C 110.626 -0.139 . . . . 0.0 110.626 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' X' X ' 50' ' ' LYS . . . . . . . . . . . . . 65.7 mmtt 39.64 55.69 2.39 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-O 120.583 0.23 . . . . 0.0 110.712 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' X' X ' 51' ' ' THR . . . . . . . . . . . . . 99.7 m -138.31 129.65 27.48 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.018 -179.6 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' X' X ' 52' ' ' PHE . . . . . 0.63 ' CZ ' ' CD1' ' X' ' 45' ' ' TYR . 87.3 m-85 -107.29 154.26 21.52 Favored 'General case' 0 C--N 1.342 0.281 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 179.46 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 53' ' ' THR . . . . . 0.507 ' OG1' ' CG2' ' X' ' 44' ' ' THR . 24.2 p -151.9 130.44 12.23 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 120.599 -0.44 . . . . 0.0 110.253 178.956 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 54' ' ' VAL . . . . . 0.513 ' CG2' ' H ' ' X' ' 41' ' ' GLY . 10.6 p -113.42 123.7 69.33 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 178.871 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 55' ' ' THR . . . . . 0.538 HG23 ' O ' ' X' ' 55' ' ' THR . 4.8 t -125.35 120.7 31.84 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.511 -178.425 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 56' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 . . . . . 0 C--O 1.22 -0.461 0 CA-C-O 118.073 -0.965 . . . . 0.0 110.136 179.252 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' X' X ' 2' ' ' GLN . . . . . . . . . . . . . 15.5 mm-40 . . . . . 0 N--CA 1.468 0.463 0 CA-C-O 121.049 0.452 . . . . 0.0 110.92 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' X' X ' 3' ' ' TYR . . . . . 0.533 ' O ' HG23 ' X' ' 17' ' ' THR . 38.1 m-85 -125.61 137.01 53.87 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.771 -0.65 . . . . 0.0 109.412 179.17 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 4' ' ' LYS . . . . . . . . . . . . . 44.8 tttp -119.97 128.06 53.22 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 120.923 0.392 . . . . 0.0 110.703 -179.821 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' X' X ' 5' ' ' LEU . . . . . 0.71 ' C ' HD13 ' X' ' 5' ' ' LEU . 1.0 OUTLIER -109.29 127.94 54.69 Favored 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 179.435 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' X' X ' 6' ' ' ILE . . . . . 0.537 ' N ' HD22 ' X' ' 5' ' ' LEU . 27.0 mm -98.99 132.35 44.51 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 CA-C-O 120.948 0.404 . . . . 0.0 110.176 -179.386 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 7' ' ' LEU . . . . . 0.406 ' HB2' ' H ' ' X' ' 14' ' ' GLY . 6.0 mp -92.66 110.24 21.66 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.664 -179.19 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 8' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 -132.91 87.52 2.41 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 178.298 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' X' X ' 9' ' ' GLY . . . . . 0.837 ' C ' ' HZ1' ' X' ' 13' ' ' LYS . . . -122.79 -147.35 7.39 Favored Glycine 0 N--CA 1.464 0.537 0 N-CA-C 111.462 -0.655 . . . . 0.0 111.462 -179.203 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 10' ' ' LYS . . . . . . . . . . . . . 57.1 mttt -79.17 -50.15 11.43 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 120.989 -0.284 . . . . 0.0 111.46 -179.486 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' X' X ' 11' ' ' THR . . . . . 0.436 ' C ' ' HZ3' ' X' ' 13' ' ' LYS . 41.5 p -130.35 -19.62 3.09 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 -179.427 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 12' ' ' LEU . . . . . 0.749 ' N ' ' HZ3' ' X' ' 13' ' ' LYS . 0.5 OUTLIER -92.15 119.51 31.87 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-O 120.648 0.261 . . . . 0.0 111.156 -178.943 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' X' X ' 13' ' ' LYS . . . . . 0.837 ' HZ1' ' C ' ' X' ' 9' ' ' GLY . 0.1 OUTLIER -140.18 139.24 35.66 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 120.907 0.384 . . . . 0.0 110.255 179.449 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' X' X ' 14' ' ' GLY . . . . . 0.438 ' O ' ' OE1' ' X' ' 15' ' ' GLU . . . 173.79 -155.01 21.13 Favored Glycine 0 CA--C 1.533 1.216 0 N-CA-C 110.671 -0.972 . . . . 0.0 110.671 -179.933 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 15' ' ' GLU . . . . . 0.438 ' OE1' ' O ' ' X' ' 14' ' ' GLY . 5.0 mm-40 -133.82 151.09 51.46 Favored 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 110.098 -0.334 . . . . 0.0 110.098 179.622 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 2.8 m -147.86 129.18 14.78 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.052 178.924 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' X' X ' 17' ' ' THR . . . . . 0.533 HG23 ' O ' ' X' ' 3' ' ' TYR . 2.4 m -129.47 157.05 43.08 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-O 121.003 0.43 . . . . 0.0 110.551 179.936 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 18' ' ' THR . . . . . . . . . . . . . 7.2 t -150.55 152.69 34.52 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.601 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' X' X ' 19' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -104.42 105.61 15.8 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.846 -0.427 . . . . 0.0 109.846 -179.626 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' X' X ' 20' ' ' ALA . . . . . . . . . . . . . . . -136.39 163.29 30.79 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.728 -179.668 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' X' X ' 21' ' ' VAL . . . . . 0.447 ' H ' HG12 ' X' ' 21' ' ' VAL . 1.1 p -89.04 -41.23 13.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.358 179.356 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 22' ' ' ASP . . . . . . . . . . . . . 46.5 t0 -102.27 152.71 20.74 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.335 -179.267 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' X' X ' 23' ' ' ALA . . . . . . . . . . . . . . . -75.14 -39.68 60.28 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.73 179.645 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' X' X ' 24' ' ' ALA . . . . . . . . . . . . . . . -67.51 -39.84 85.12 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.332 -179.087 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' X' X ' 25' ' ' THR . . . . . . . . . . . . . 1.2 t -64.24 -33.33 75.57 Favored 'General case' 0 C--N 1.345 0.409 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.62 -179.73 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' X' X ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.12 -35.99 79.01 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.973 0.416 . . . . 0.0 110.681 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' X' X ' 27' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -62.88 -28.43 70.03 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.594 -179.607 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' X' X ' 28' ' ' LYS . . . . . . . . . . . . . 83.5 mttt -57.17 -43.77 82.9 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 120.588 -0.445 . . . . 0.0 109.805 -179.163 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' X' X ' 29' ' ' VAL . . . . . 0.451 ' O ' ' N ' ' X' ' 33' ' ' TYR . 11.9 t -70.24 -50.88 43.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.588 179.296 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 30' ' ' PHE . . . . . . . . . . . . . 56.0 m-85 -61.76 -43.93 97.88 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.181 -0.463 . . . . 0.0 112.011 -179.236 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' X' X ' 31' ' ' LYS . . . . . . . . . . . . . 69.7 mttt -69.26 -41.76 76.48 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 120.173 -0.611 . . . . 0.0 110.281 -179.794 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' X' X ' 32' ' ' GLN . . . . . . . . . . . . . 59.6 tp60 -73.2 -33.14 65.22 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.038 0.447 . . . . 0.0 110.039 179.226 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' X' X ' 33' ' ' TYR . . . . . 0.451 ' N ' ' O ' ' X' ' 29' ' ' VAL . 69.3 t80 -71.23 -42.18 69.2 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.12 -179.794 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 34' ' ' ALA . . . . . 0.408 ' HB1' ' O ' ' X' ' 39' ' ' VAL . . . -58.73 -38.08 77.58 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 120.839 -0.344 . . . . 0.0 110.4 -179.09 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 35' ' ' ASN . . . . . . . . . . . . . 40.3 t-20 -63.19 -45.54 91.27 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 179.042 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' X' X ' 36' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -66.81 -25.02 66.25 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.622 179.415 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' X' X ' 37' ' ' ASN . . . . . 0.407 ' O ' HD12 ' X' ' 12' ' ' LEU . 0.1 OUTLIER -85.09 -26.53 26.89 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.983 -178.839 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' X' X ' 38' ' ' GLY . . . . . . . . . . . . . . . 113.19 -37.91 3.43 Favored Glycine 0 CA--C 1.531 1.052 0 C-N-CA 121.541 -0.362 . . . . 0.0 112.973 178.354 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' X' X ' 39' ' ' VAL . . . . . 0.408 ' O ' ' HB1' ' X' ' 34' ' ' ALA . 1.5 p -80.63 108.64 14.22 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.394 0 CA-C-N 117.73 0.765 . . . . 0.0 111.161 -178.551 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 40' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -127.42 110.85 13.2 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.677 179.172 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' X' X ' 41' ' ' GLY . . . . . 0.502 ' H ' ' CG2' ' X' ' 54' ' ' VAL . . . -142.26 -155.17 6.35 Favored Glycine 0 CA--C 1.532 1.11 0 C-N-CA 120.606 -0.807 . . . . 0.0 111.981 -179.407 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 42' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -75.12 132.06 40.95 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-O 120.885 0.374 . . . . 0.0 110.152 -179.699 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' X' X ' 43' ' ' TRP . . . . . . . . . . . . . 81.5 m95 -97.92 161.41 13.75 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.65 0.738 . . . . 0.0 112.05 -178.672 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' X' X ' 44' ' ' THR . . . . . 0.502 ' CG2' ' OG1' ' X' ' 53' ' ' THR . 2.5 t -157.0 169.07 25.66 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 114.509 -1.223 . . . . 0.0 108.885 179.483 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 45' ' ' TYR . . . . . 0.615 ' CD1' ' CE1' ' X' ' 52' ' ' PHE . 2.6 t80 -173.9 135.55 0.5 Allowed 'General case' 0 C--N 1.331 -0.21 0 C-N-CA 119.697 -0.801 . . . . 0.0 111.691 -179.917 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 46' ' ' ASP . . . . . 0.539 ' N ' ' CD1' ' X' ' 45' ' ' TYR . 8.1 t0 -123.84 112.6 17.47 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 115.155 -0.929 . . . . 0.0 108.872 178.067 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 47' ' ' ASP . . . . . 0.422 ' OD1' ' OH ' ' X' ' 45' ' ' TYR . 25.0 t0 -66.47 -15.48 63.38 Favored 'General case' 0 C--O 1.23 0.057 0 CA-C-O 120.728 0.299 . . . . 0.0 110.856 -179.722 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.51 -14.88 58.57 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.069 -179.702 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' X' X ' 49' ' ' THR . . . . . . . . . . . . . 2.7 p -128.28 3.84 5.75 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 121.394 -0.122 . . . . 0.0 110.792 -179.656 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' X' X ' 50' ' ' LYS . . . . . . . . . . . . . 64.3 mmtt 40.89 57.34 2.74 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 120.922 -0.311 . . . . 0.0 110.693 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' X' X ' 51' ' ' THR . . . . . . . . . . . . . 85.1 m -146.62 127.88 14.81 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 120.725 0.298 . . . . 0.0 111.747 -179.435 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' X' X ' 52' ' ' PHE . . . . . 0.615 ' CE1' ' CD1' ' X' ' 45' ' ' TYR . 10.5 m-85 -107.64 154.11 21.92 Favored 'General case' 0 C--N 1.342 0.261 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 178.749 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 53' ' ' THR . . . . . 0.502 ' OG1' ' CG2' ' X' ' 44' ' ' THR . 36.4 p -150.97 130.36 12.88 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 120.447 -0.501 . . . . 0.0 110.187 179.07 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 54' ' ' VAL . . . . . 0.502 ' CG2' ' H ' ' X' ' 41' ' ' GLY . 14.4 p -113.51 123.92 69.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 179.192 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 55' ' ' THR . . . . . 0.507 HG23 ' O ' ' X' ' 55' ' ' THR . 4.3 t -125.24 121.38 33.91 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.525 -178.599 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 56' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 . . . . . 0 C--O 1.219 -0.533 0 CA-C-O 118.067 -0.968 . . . . 0.0 110.035 179.499 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' X' X ' 2' ' ' GLN . . . . . . . . . . . . . 83.6 mt-30 . . . . . 0 N--CA 1.465 0.314 0 CA-C-O 121.004 0.43 . . . . 0.0 111.51 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' X' X ' 3' ' ' TYR . . . . . 0.515 ' O ' HG23 ' X' ' 17' ' ' THR . 62.6 m-85 -116.93 139.63 50.42 Favored 'General case' 0 CA--C 1.517 -0.303 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 178.729 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 4' ' ' LYS . . . . . . . . . . . . . 52.3 tttp -120.93 127.83 52.19 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-O 120.911 0.386 . . . . 0.0 110.925 -179.3 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' X' X ' 5' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -105.01 129.0 53.56 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 179.08 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 6' ' ' ILE . . . . . . . . . . . . . 32.1 mm -100.94 129.79 51.31 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.419 0 N-CA-C 109.63 -0.508 . . . . 0.0 109.63 178.696 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' X' X ' 7' ' ' LEU . . . . . 0.407 ' HB2' ' H ' ' X' ' 14' ' ' GLY . 5.1 mp -93.43 110.04 21.61 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.771 -179.587 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 8' ' ' ASN . . . . . 0.523 ' OD1' ' N ' ' X' ' 8' ' ' ASN . 5.1 p-10 -134.83 87.36 2.33 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 178.039 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 9' ' ' GLY . . . . . 0.86 ' C ' ' HZ1' ' X' ' 13' ' ' LYS . . . -122.24 -145.84 7.13 Favored Glycine 0 N--CA 1.464 0.546 0 N-CA-C 111.527 -0.629 . . . . 0.0 111.527 -179.302 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 10' ' ' LYS . . . . . . . . . . . . . 41.2 mtmt -80.61 -49.49 11.21 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 121.157 -0.217 . . . . 0.0 111.551 -179.381 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' X' X ' 11' ' ' THR . . . . . 0.426 ' C ' ' HZ3' ' X' ' 13' ' ' LYS . 41.6 p -129.97 -19.45 3.24 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -179.34 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 12' ' ' LEU . . . . . 0.766 ' N ' ' HZ3' ' X' ' 13' ' ' LYS . 0.4 OUTLIER -93.12 119.18 32.05 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 120.624 0.249 . . . . 0.0 111.066 -178.954 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' X' X ' 13' ' ' LYS . . . . . 0.86 ' HZ1' ' C ' ' X' ' 9' ' ' GLY . 0.1 OUTLIER -141.52 139.21 33.19 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-O 120.974 0.416 . . . . 0.0 110.351 179.351 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' X' X ' 14' ' ' GLY . . . . . 0.438 ' O ' ' OE1' ' X' ' 15' ' ' GLU . . . 173.62 -155.11 21.52 Favored Glycine 0 CA--C 1.533 1.195 0 N-CA-C 110.771 -0.932 . . . . 0.0 110.771 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 15' ' ' GLU . . . . . 0.438 ' OE1' ' O ' ' X' ' 14' ' ' GLY . 6.6 mm-40 -129.72 154.64 46.97 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.85 0.357 . . . . 0.0 110.218 179.553 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -147.54 145.47 29.09 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.067 179.797 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 17' ' ' THR . . . . . 0.515 HG23 ' O ' ' X' ' 3' ' ' TYR . 1.8 m -146.11 157.25 43.84 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.943 0.401 . . . . 0.0 111.048 179.23 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 18' ' ' THR . . . . . . . . . . . . . 7.4 t -155.24 152.9 29.86 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.102 179.636 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' X' X ' 19' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -104.42 105.91 16.21 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 179.805 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 20' ' ' ALA . . . . . . . . . . . . . . . -130.64 159.01 38.48 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 121.107 0.48 . . . . 0.0 110.793 -179.849 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' X' X ' 21' ' ' VAL . . . . . 0.441 ' H ' HG12 ' X' ' 21' ' ' VAL . 1.0 OUTLIER -82.14 -41.09 17.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.316 179.118 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' X' X ' 22' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -111.56 157.3 20.53 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.131 -179.45 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' X' X ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.88 -42.92 56.93 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.659 -0.701 . . . . 0.0 111.133 179.849 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' X' X ' 24' ' ' ALA . . . . . . . . . . . . . . . -66.34 -41.38 89.66 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.563 -178.927 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' X' X ' 25' ' ' THR . . . . . . . . . . . . . 1.2 t -59.63 -35.61 74.72 Favored 'General case' 0 C--N 1.345 0.406 0 C-N-CA 120.734 -0.386 . . . . 0.0 110.716 -179.619 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' X' X ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.85 -35.02 77.84 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.924 0.392 . . . . 0.0 110.655 -179.925 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' X' X ' 27' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -57.25 -29.32 63.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.806 -179.317 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 28' ' ' LYS . . . . . . . . . . . . . 41.8 mtmt -57.34 -43.85 83.77 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.234 -178.819 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' X' X ' 29' ' ' VAL . . . . . 0.444 ' O ' ' CB ' ' X' ' 33' ' ' TYR . 19.1 t -69.47 -46.35 76.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.174 179.168 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 30' ' ' PHE . . . . . . . . . . . . . 8.4 m-30 -61.52 -43.41 98.91 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.308 -179.621 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' X' X ' 31' ' ' LYS . . . . . . . . . . . . . 2.4 tppt? -63.14 -50.1 71.76 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 120.335 -0.546 . . . . 0.0 110.763 -179.459 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' X' X ' 32' ' ' GLN . . . . . . . . . . . . . 93.7 mm-40 -73.52 -34.44 65.24 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.317 -179.659 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' X' X ' 33' ' ' TYR . . . . . 0.676 ' CZ ' ' ND2' ' X' ' 37' ' ' ASN . 69.0 t80 -61.74 -43.48 98.78 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.88 -179.535 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 34' ' ' ALA . . . . . 0.553 ' HB1' ' O ' ' X' ' 39' ' ' VAL . . . -59.11 -37.63 77.65 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.421 -179.082 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 35' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -64.18 -47.22 80.65 Favored 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 179.221 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' X' X ' 36' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -66.87 -26.08 66.72 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.645 179.602 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' X' X ' 37' ' ' ASN . . . . . 0.676 ' ND2' ' CZ ' ' X' ' 33' ' ' TYR . 0.8 OUTLIER -84.0 -26.66 28.99 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.807 -179.283 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' X' X ' 38' ' ' GLY . . . . . . . . . . . . . . . 112.15 -39.25 2.93 Favored Glycine 0 CA--C 1.531 1.076 0 C-N-CA 121.555 -0.355 . . . . 0.0 112.364 178.622 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' X' X ' 39' ' ' VAL . . . . . 0.553 ' O ' ' HB1' ' X' ' 34' ' ' ALA . 1.6 p -80.78 108.75 14.46 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 CA-C-N 117.4 0.6 . . . . 0.0 111.211 -178.774 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 40' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -127.71 112.31 14.67 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.737 179.306 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' X' X ' 41' ' ' GLY . . . . . 0.469 ' H ' ' CG2' ' X' ' 54' ' ' VAL . . . -142.92 -153.73 5.96 Favored Glycine 0 CA--C 1.533 1.197 0 C-N-CA 120.337 -0.935 . . . . 0.0 112.283 -179.431 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 42' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -74.53 139.13 43.58 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 -179.899 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' X' X ' 43' ' ' TRP . . . . . . . . . . . . . 90.8 m95 -102.83 162.36 12.99 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.817 0.817 . . . . 0.0 112.686 -178.052 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' X' X ' 44' ' ' THR . . . . . 0.5 ' CG2' ' OG1' ' X' ' 53' ' ' THR . 2.8 t -156.9 167.85 29.23 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.35 -1.295 . . . . 0.0 108.821 179.206 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 45' ' ' TYR . . . . . 0.629 ' CD1' ' CE1' ' X' ' 52' ' ' PHE . 19.1 t80 -172.88 134.45 0.59 Allowed 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 119.748 -0.781 . . . . 0.0 111.771 179.992 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 46' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -123.66 112.33 17.27 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 115.25 -0.886 . . . . 0.0 108.708 177.87 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' X' X ' 47' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -68.61 -16.33 63.81 Favored 'General case' 0 C--O 1.231 0.121 0 CA-C-O 120.815 0.341 . . . . 0.0 110.988 -179.552 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' X' X ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.16 -13.56 59.64 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.101 -179.824 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' X' X ' 49' ' ' THR . . . . . . . . . . . . . 2.5 p -128.22 3.0 5.77 Favored 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 110.508 -0.182 . . . . 0.0 110.508 -179.793 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' X' X ' 50' ' ' LYS . . . . . . . . . . . . . 64.5 mmtt 41.54 57.48 2.99 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 120.908 -0.317 . . . . 0.0 110.544 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' X' X ' 51' ' ' THR . . . . . . . . . . . . . 96.9 m -147.01 128.67 15.17 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 111.891 0.33 . . . . 0.0 111.891 -179.346 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' X' X ' 52' ' ' PHE . . . . . 0.629 ' CE1' ' CD1' ' X' ' 45' ' ' TYR . 27.9 m-85 -107.84 156.23 19.39 Favored 'General case' 0 C--N 1.345 0.376 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 178.717 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 53' ' ' THR . . . . . 0.5 ' OG1' ' CG2' ' X' ' 44' ' ' THR . 11.6 p -152.14 128.83 10.82 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 178.767 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 54' ' ' VAL . . . . . 0.469 ' CG2' ' H ' ' X' ' 41' ' ' GLY . 10.4 p -112.74 123.98 68.95 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 178.776 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 55' ' ' THR . . . . . 0.471 HG23 ' O ' ' X' ' 55' ' ' THR . 3.0 t -124.93 123.27 39.54 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 116.561 -0.291 . . . . 0.0 111.708 -178.053 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 56' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 . . . . . 0 C--O 1.22 -0.494 0 CA-C-O 118.015 -0.993 . . . . 0.0 110.062 179.36 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' X' X ' 2' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 . . . . . 0 N--CA 1.465 0.304 0 CA-C-O 120.908 0.385 . . . . 0.0 110.622 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' X' X ' 3' ' ' TYR . . . . . 0.561 ' O ' HG23 ' X' ' 17' ' ' THR . 73.5 m-85 -115.3 142.66 46.38 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.463 179.462 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 4' ' ' LYS . . . . . . . . . . . . . 10.1 ttmm -119.45 127.2 52.86 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 121.024 0.44 . . . . 0.0 110.187 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' X' X ' 5' ' ' LEU . . . . . 0.708 ' C ' HD13 ' X' ' 5' ' ' LEU . 1.0 OUTLIER -107.8 127.64 53.89 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 179.664 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' X' X ' 6' ' ' ILE . . . . . 0.537 ' N ' HD22 ' X' ' 5' ' ' LEU . 29.2 mm -98.4 132.24 43.9 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.467 0 CA-C-O 120.907 0.384 . . . . 0.0 110.073 -179.474 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 7' ' ' LEU . . . . . 0.418 HD23 HD22 ' X' ' 12' ' ' LEU . 6.2 mp -91.91 113.62 25.94 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.283 -179.156 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 8' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -131.78 87.73 2.48 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 178.165 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' X' X ' 9' ' ' GLY . . . . . 0.62 ' H ' ' NZ ' ' X' ' 13' ' ' LYS . . . -124.62 -163.24 11.62 Favored Glycine 0 N--CA 1.463 0.48 0 N-CA-C 111.542 -0.623 . . . . 0.0 111.542 -178.68 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 10' ' ' LYS . . . . . . . . . . . . . 55.5 mttt -75.94 -48.86 19.56 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 120.86 -0.336 . . . . 0.0 110.982 -179.692 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' X' X ' 11' ' ' THR . . . . . . . . . . . . . 41.3 p -130.73 19.3 5.12 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 112.177 0.436 . . . . 0.0 112.177 -179.301 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' X' X ' 12' ' ' LEU . . . . . 0.765 ' H ' ' HZ1' ' X' ' 13' ' ' LYS . 0.5 OUTLIER -138.4 108.12 6.26 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 120.848 0.356 . . . . 0.0 111.337 -179.435 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' X' X ' 13' ' ' LYS . . . . . 0.765 ' HZ1' ' H ' ' X' ' 12' ' ' LEU . 0.2 OUTLIER -131.78 139.94 49.06 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.264 179.429 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' X' X ' 14' ' ' GLY . . . . . 0.412 ' H ' ' HB2' ' X' ' 7' ' ' LEU . . . 174.6 -155.19 20.59 Favored Glycine 0 CA--C 1.535 1.323 0 N-CA-C 110.839 -0.905 . . . . 0.0 110.839 -179.794 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 15' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -134.4 149.94 50.84 Favored 'General case' 0 N--CA 1.468 0.449 0 O-C-N 122.717 -0.284 . . . . 0.0 110.517 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 2.7 m -148.28 129.5 14.64 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 120.88 -0.328 . . . . 0.0 110.343 178.859 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' X' X ' 17' ' ' THR . . . . . 0.561 HG23 ' O ' ' X' ' 3' ' ' TYR . 2.6 m -131.66 157.24 44.23 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 120.92 0.39 . . . . 0.0 110.451 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 18' ' ' THR . . . . . . . . . . . . . 7.1 t -152.67 152.81 32.17 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.087 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' X' X ' 19' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -104.2 105.86 16.16 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.785 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' X' X ' 20' ' ' ALA . . . . . . . . . . . . . . . -130.01 162.64 28.24 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.998 -179.336 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' X' X ' 21' ' ' VAL . . . . . 0.442 HG12 ' H ' ' X' ' 21' ' ' VAL . 1.2 p -82.98 -37.58 13.95 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.268 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.716 179.515 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 22' ' ' ASP . . . . . 0.509 ' OD1' ' N ' ' X' ' 23' ' ' ALA . 33.0 t0 -115.47 156.25 25.99 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.943 -179.532 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 23' ' ' ALA . . . . . 0.509 ' N ' ' OD1' ' X' ' 22' ' ' ASP . . . -74.94 -42.78 57.01 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.026 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 24' ' ' ALA . . . . . . . . . . . . . . . -65.71 -39.26 91.01 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.669 -179.054 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' X' X ' 25' ' ' THR . . . . . . . . . . . . . 1.2 t -63.21 -34.57 77.93 Favored 'General case' 0 C--N 1.346 0.437 0 C-N-CA 120.669 -0.413 . . . . 0.0 110.7 -179.561 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' X' X ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.0 -35.82 78.96 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.904 0.383 . . . . 0.0 110.73 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' X' X ' 27' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -58.27 -29.08 65.53 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.665 -179.779 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' X' X ' 28' ' ' LYS . . . . . 0.416 ' O ' ' OE1' ' X' ' 32' ' ' GLN . 41.4 mtmt -57.22 -43.49 82.86 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 120.456 -0.498 . . . . 0.0 110.031 -179.079 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 29' ' ' VAL . . . . . 0.43 ' O ' ' CB ' ' X' ' 33' ' ' TYR . 12.1 t -69.95 -50.76 45.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.459 179.394 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 30' ' ' PHE . . . . . . . . . . . . . 57.9 m-85 -61.54 -43.15 99.39 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.878 -179.319 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' X' X ' 31' ' ' LYS . . . . . . . . . . . . . 68.1 mttt -70.52 -41.78 72.14 Favored 'General case' 0 C--O 1.232 0.155 0 C-N-CA 120.23 -0.588 . . . . 0.0 110.55 -179.499 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' X' X ' 32' ' ' GLN . . . . . 0.416 ' OE1' ' O ' ' X' ' 28' ' ' LYS . 79.2 mt-30 -73.14 -33.52 65.55 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.02 0.438 . . . . 0.0 109.853 179.218 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 33' ' ' TYR . . . . . 0.43 ' CB ' ' O ' ' X' ' 29' ' ' VAL . 27.2 t80 -64.98 -37.62 88.24 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.518 179.844 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 34' ' ' ALA . . . . . 0.52 ' HB1' ' O ' ' X' ' 39' ' ' VAL . . . -59.68 -40.18 86.98 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.611 -179.456 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 35' ' ' ASN . . . . . . . . . . . . . 9.6 m-80 -68.24 -38.44 81.85 Favored 'General case' 0 N--CA 1.456 -0.151 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 179.326 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' X' X ' 36' ' ' ASP . . . . . 0.477 ' N ' ' OD1' ' X' ' 36' ' ' ASP . 0.9 OUTLIER -67.51 -32.15 72.76 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 115.492 -0.776 . . . . 0.0 112.055 -179.866 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' X' X ' 37' ' ' ASN . . . . . 0.623 HD21 ' CG1' ' X' ' 39' ' ' VAL . 17.8 p-10 -91.78 -24.73 19.32 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 -178.431 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 38' ' ' GLY . . . . . 0.543 ' N ' ' OD1' ' X' ' 37' ' ' ASN . . . 118.55 -37.98 3.04 Favored Glycine 0 CA--C 1.534 1.278 0 C-N-CA 121.236 -0.507 . . . . 0.0 113.886 177.726 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 39' ' ' VAL . . . . . 0.623 ' CG1' HD21 ' X' ' 37' ' ' ASN . 1.5 p -80.16 108.39 13.56 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 CA-C-N 118.009 0.905 . . . . 0.0 111.442 -178.064 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 40' ' ' ASP . . . . . . . . . . . . . 22.0 t0 -127.79 111.76 14.01 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.907 179.267 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' X' X ' 41' ' ' GLY . . . . . 0.514 ' H ' ' CG2' ' X' ' 54' ' ' VAL . . . -141.23 -155.37 6.46 Favored Glycine 0 CA--C 1.534 1.27 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.038 -179.589 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 42' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -75.0 136.76 41.25 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-O 120.702 0.287 . . . . 0.0 110.266 -179.682 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' X' X ' 43' ' ' TRP . . . . . . . . . . . . . 82.4 m95 -103.23 162.01 13.33 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.898 0.856 . . . . 0.0 112.535 -178.3 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' X' X ' 44' ' ' THR . . . . . 0.475 ' CG2' ' OG1' ' X' ' 53' ' ' THR . 9.0 t -157.06 166.99 31.76 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 114.071 -1.422 . . . . 0.0 108.384 179.103 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 45' ' ' TYR . . . . . 0.629 ' CE1' ' CE1' ' X' ' 52' ' ' PHE . 16.8 t80 -172.46 133.78 0.65 Allowed 'General case' 0 C--N 1.332 -0.195 0 C-N-CA 119.607 -0.837 . . . . 0.0 112.079 179.943 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 46' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -123.9 112.47 17.29 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 115.125 -0.943 . . . . 0.0 108.482 177.673 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' X' X ' 47' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -67.69 -16.29 64.07 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-O 120.672 0.272 . . . . 0.0 111.068 -179.388 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' X' X ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.35 -14.81 58.73 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.141 -179.77 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' X' X ' 49' ' ' THR . . . . . . . . . . . . . 2.8 p -125.73 2.8 7.48 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 110.44 -0.208 . . . . 0.0 110.44 -179.866 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' X' X ' 50' ' ' LYS . . . . . . . . . . . . . 67.0 mmtt 41.61 58.46 2.74 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 120.884 -0.326 . . . . 0.0 110.551 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' X' X ' 51' ' ' THR . . . . . . . . . . . . . 97.4 m -147.71 126.69 12.8 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 112.132 0.419 . . . . 0.0 112.132 -179.34 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' X' X ' 52' ' ' PHE . . . . . 0.629 ' CE1' ' CE1' ' X' ' 45' ' ' TYR . 26.8 m-85 -107.92 155.55 20.18 Favored 'General case' 0 C--N 1.344 0.352 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 178.436 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 53' ' ' THR . . . . . 0.475 ' OG1' ' CG2' ' X' ' 44' ' ' THR . 47.0 p -151.98 129.49 11.43 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 120.401 -0.52 . . . . 0.0 110.492 179.202 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 54' ' ' VAL . . . . . 0.514 ' CG2' ' H ' ' X' ' 41' ' ' GLY . 10.7 p -113.69 123.62 69.53 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.497 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 178.964 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 55' ' ' THR . . . . . 0.542 HG23 ' O ' ' X' ' 55' ' ' THR . 4.9 t -125.46 119.89 29.46 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.299 -178.716 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 56' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 . . . . . 0 C--O 1.219 -0.507 0 CA-C-O 118.009 -0.996 . . . . 0.0 110.088 179.635 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' X' X ' 2' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 . . . . . 0 N--CA 1.464 0.263 0 CA-C-O 120.908 0.385 . . . . 0.0 110.972 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' X' X ' 3' ' ' TYR . . . . . 0.524 ' O ' HG23 ' X' ' 17' ' ' THR . 61.3 m-85 -122.36 137.68 54.77 Favored 'General case' 0 CA--C 1.518 -0.259 0 CA-C-N 115.835 -0.621 . . . . 0.0 109.495 179.213 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 4' ' ' LYS . . . . . . . . . . . . . 45.3 tttp -119.58 127.62 53.14 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 120.978 0.418 . . . . 0.0 110.721 -179.639 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 5' ' ' LEU . . . . . 0.695 ' C ' HD13 ' X' ' 5' ' ' LEU . 1.0 OUTLIER -108.76 127.77 54.3 Favored 'General case' 0 N--CA 1.464 0.271 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 179.077 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' X' X ' 6' ' ' ILE . . . . . 0.531 ' N ' HD22 ' X' ' 5' ' ' LEU . 29.1 mm -98.12 132.57 42.81 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.46 0 CA-C-O 121.137 0.494 . . . . 0.0 110.006 -179.207 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 7' ' ' LEU . . . . . 0.475 HD23 HD22 ' X' ' 12' ' ' LEU . 6.0 mp -91.65 115.26 27.9 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.443 -178.922 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 8' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -134.28 86.95 2.31 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 108.045 -1.095 . . . . 0.0 108.045 177.578 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 9' ' ' GLY . . . . . 0.516 ' H ' ' HD3' ' X' ' 13' ' ' LYS . . . -125.97 -163.36 11.53 Favored Glycine 0 C--N 1.335 0.479 0 N-CA-C 111.506 -0.638 . . . . 0.0 111.506 -178.871 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 10' ' ' LYS . . . . . . . . . . . . . 57.8 mttt -76.97 -46.98 22.15 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.973 -0.291 . . . . 0.0 111.155 -179.655 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 11' ' ' THR . . . . . . . . . . . . . 42.1 p -130.57 18.33 5.26 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 -179.26 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 12' ' ' LEU . . . . . 0.657 ' N ' ' HZ2' ' X' ' 13' ' ' LYS . 0.3 OUTLIER -138.59 100.4 4.07 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 120.87 -0.332 . . . . 0.0 111.52 -179.632 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' X' X ' 13' ' ' LYS . . . . . 0.657 ' HZ2' ' N ' ' X' ' 12' ' ' LEU . 0.0 OUTLIER -122.21 137.56 54.79 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 178.895 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' X' X ' 14' ' ' GLY . . . . . 0.435 ' O ' ' OE1' ' X' ' 15' ' ' GLU . . . 173.44 -155.16 21.8 Favored Glycine 0 CA--C 1.534 1.271 0 N-CA-C 110.923 -0.871 . . . . 0.0 110.923 -179.902 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 15' ' ' GLU . . . . . 0.435 ' OE1' ' O ' ' X' ' 14' ' ' GLY . 5.1 mm-40 -134.73 150.64 50.6 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 110.061 -0.348 . . . . 0.0 110.061 179.615 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 1.9 m -148.08 129.67 14.99 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.301 178.926 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 17' ' ' THR . . . . . 0.524 HG23 ' O ' ' X' ' 3' ' ' TYR . 2.3 m -129.41 157.21 42.6 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 120.98 0.419 . . . . 0.0 110.608 179.858 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 18' ' ' THR . . . . . . . . . . . . . 7.4 t -149.26 153.31 37.38 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.85 -179.854 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 19' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -103.81 105.67 15.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.218 -0.446 . . . . 0.0 109.847 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 20' ' ' ALA . . . . . . . . . . . . . . . -136.28 161.97 34.3 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.635 -179.695 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 21' ' ' VAL . . . . . 0.422 ' H ' HG12 ' X' ' 21' ' ' VAL . 1.1 p -87.3 -40.79 14.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.44 179.345 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 22' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -104.75 155.78 18.58 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.402 -179.163 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 23' ' ' ALA . . . . . . . . . . . . . . . -75.09 -45.94 37.93 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.943 179.772 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 24' ' ' ALA . . . . . . . . . . . . . . . -62.88 -40.22 96.85 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.518 -179.059 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 25' ' ' THR . . . . . . . . . . . . . 1.2 t -63.28 -33.06 74.68 Favored 'General case' 0 C--N 1.346 0.432 0 O-C-N 122.016 -0.428 . . . . 0.0 110.716 -179.706 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.1 -35.84 78.8 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.88 0.371 . . . . 0.0 110.581 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 27' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -62.46 -28.57 69.91 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.509 -179.733 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 28' ' ' LYS . . . . . 0.418 ' O ' ' OE1' ' X' ' 32' ' ' GLN . 84.0 mttt -57.51 -43.88 84.6 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.255 -0.429 . . . . 0.0 109.885 -179.012 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 29' ' ' VAL . . . . . 0.441 ' O ' ' CB ' ' X' ' 33' ' ' TYR . 13.1 t -70.03 -50.27 49.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.498 179.366 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 30' ' ' PHE . . . . . . . . . . . . . 55.9 m-85 -61.67 -43.53 98.67 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.831 -179.363 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 31' ' ' LYS . . . . . . . . . . . . . 72.0 mttt -69.5 -42.14 75.13 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 120.352 -0.539 . . . . 0.0 110.49 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 32' ' ' GLN . . . . . 0.418 ' OE1' ' O ' ' X' ' 28' ' ' LYS . 79.6 mt-30 -73.21 -33.24 65.26 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.044 0.45 . . . . 0.0 109.954 179.371 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 33' ' ' TYR . . . . . 0.67 ' CZ ' ' ND2' ' X' ' 37' ' ' ASN . 65.9 t80 -68.31 -36.97 80.13 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.704 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.23 -38.51 80.15 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.43 -179.23 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 35' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -60.85 -48.09 83.4 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 109.835 -0.432 . . . . 0.0 109.835 179.39 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 36' ' ' ASP . . . . . 0.407 ' OD1' ' N ' ' X' ' 36' ' ' ASP . 1.6 m-20 -66.87 -24.44 66.12 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.977 179.554 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 37' ' ' ASN . . . . . 0.67 ' ND2' ' CZ ' ' X' ' 33' ' ' TYR . 0.4 OUTLIER -86.62 -26.81 24.21 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.082 -178.702 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' X' X ' 38' ' ' GLY . . . . . . . . . . . . . . . 106.48 -34.98 5.34 Favored Glycine 0 CA--C 1.532 1.146 0 C-N-CA 121.343 -0.456 . . . . 0.0 112.915 178.499 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 39' ' ' VAL . . . . . 0.426 HG12 ' H ' ' X' ' 39' ' ' VAL . 2.1 p -80.4 107.88 13.23 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 CA-C-N 117.728 0.764 . . . . 0.0 110.873 -178.831 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 40' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -127.8 110.83 12.99 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 115.789 -0.642 . . . . 0.0 109.964 179.551 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 41' ' ' GLY . . . . . 0.513 ' H ' ' CG2' ' X' ' 54' ' ' VAL . . . -141.28 -155.39 6.46 Favored Glycine 0 CA--C 1.532 1.115 0 C-N-CA 120.763 -0.732 . . . . 0.0 111.769 -179.541 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 42' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -75.08 131.14 40.34 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 120.94 0.4 . . . . 0.0 110.202 -179.792 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 43' ' ' TRP . . . . . . . . . . . . . 83.6 m95 -97.38 161.42 13.8 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.651 0.739 . . . . 0.0 112.101 -178.764 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 44' ' ' THR . . . . . 0.5 ' CG2' ' OG1' ' X' ' 53' ' ' THR . 2.5 t -157.05 167.95 28.91 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.559 -1.2 . . . . 0.0 108.786 179.33 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 45' ' ' TYR . . . . . 0.635 ' CD1' ' CE1' ' X' ' 52' ' ' PHE . 22.1 t80 -170.56 134.23 1.08 Allowed 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 119.7 -0.8 . . . . 0.0 111.856 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 46' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -123.73 112.38 17.28 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 115.145 -0.934 . . . . 0.0 108.646 177.748 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 47' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -68.45 -16.39 63.88 Favored 'General case' 0 C--O 1.231 0.096 0 CA-C-O 120.716 0.294 . . . . 0.0 110.998 -179.419 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.35 -13.55 59.55 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.068 -179.748 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 49' ' ' THR . . . . . . . . . . . . . 2.6 p -128.19 2.95 5.79 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 110.647 -0.131 . . . . 0.0 110.647 -179.768 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 50' ' ' LYS . . . . . . . . . . . . . 64.2 mmtt 41.87 57.47 3.14 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 120.754 -0.378 . . . . 0.0 110.442 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 51' ' ' THR . . . . . . . . . . . . . 94.5 m -147.26 128.3 14.58 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 112.06 0.392 . . . . 0.0 112.06 -179.309 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 52' ' ' PHE . . . . . 0.635 ' CE1' ' CD1' ' X' ' 45' ' ' TYR . 29.2 m-85 -107.81 154.82 20.99 Favored 'General case' 0 C--N 1.343 0.325 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 178.561 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 53' ' ' THR . . . . . 0.5 ' OG1' ' CG2' ' X' ' 44' ' ' THR . 34.2 p -151.42 129.1 11.53 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 120.531 -0.467 . . . . 0.0 110.312 179.126 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 54' ' ' VAL . . . . . 0.513 ' CG2' ' H ' ' X' ' 41' ' ' GLY . 12.5 p -113.57 123.81 69.59 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.448 0 N-CA-C 109.381 -0.599 . . . . 0.0 109.381 179.01 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 55' ' ' THR . . . . . 0.554 HG23 ' O ' ' X' ' 55' ' ' THR . 5.3 t -125.45 120.3 30.62 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.399 -178.469 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 56' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 . . . . . 0 C--O 1.22 -0.481 0 CA-C-O 117.971 -1.014 . . . . 0.0 110.137 179.298 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' X' X ' 2' ' ' GLN . . . . . . . . . . . . . 98.3 mt-30 . . . . . 0 N--CA 1.467 0.383 0 CA-C-O 121.278 0.561 . . . . 0.0 111.659 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' X' X ' 3' ' ' TYR . . . . . 0.523 ' O ' HG23 ' X' ' 17' ' ' THR . 63.2 m-85 -123.39 143.98 49.77 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-N 115.287 -0.87 . . . . 0.0 108.769 178.93 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 4' ' ' LYS . . . . . . . . . . . . . 5.1 tttm -119.43 128.65 54.22 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 121.053 0.454 . . . . 0.0 111.118 -179.117 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' X' X ' 5' ' ' LEU . . . . . 0.709 ' C ' HD13 ' X' ' 5' ' ' LEU . 1.0 OUTLIER -108.93 128.27 54.78 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.283 179.697 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' X' X ' 6' ' ' ILE . . . . . 0.542 ' N ' HD22 ' X' ' 5' ' ' LEU . 26.5 mm -98.88 132.73 43.62 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.439 0 CA-C-O 121.043 0.449 . . . . 0.0 110.144 -179.272 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 7' ' ' LEU . . . . . 0.481 HD21 HD22 ' X' ' 37' ' ' ASN . 6.3 mp -92.09 108.78 20.19 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.36 -179.088 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 8' ' ' ASN . . . . . . . . . . . . . 7.7 t-20 -131.2 87.72 2.51 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 178.621 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' X' X ' 9' ' ' GLY . . . . . 0.812 ' C ' ' HZ1' ' X' ' 13' ' ' LYS . . . -123.04 -147.4 7.36 Favored Glycine 0 N--CA 1.464 0.533 0 N-CA-C 111.505 -0.638 . . . . 0.0 111.505 -179.139 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 10' ' ' LYS . . . . . . . . . . . . . 48.5 mttt -77.78 -51.76 10.0 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 121.054 -0.258 . . . . 0.0 111.435 -179.453 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' X' X ' 11' ' ' THR . . . . . 0.444 ' C ' ' HZ3' ' X' ' 13' ' ' LYS . 41.5 p -130.53 -19.4 3.05 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 112.193 0.442 . . . . 0.0 112.193 -179.408 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 12' ' ' LEU . . . . . 0.779 ' N ' ' HZ3' ' X' ' 13' ' ' LYS . 0.6 OUTLIER -91.37 118.63 30.69 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 120.753 0.311 . . . . 0.0 111.165 -178.803 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' X' X ' 13' ' ' LYS . . . . . 0.812 ' HZ1' ' C ' ' X' ' 9' ' ' GLY . 0.1 OUTLIER -139.26 139.97 37.55 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 120.989 0.423 . . . . 0.0 110.434 179.65 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' X' X ' 14' ' ' GLY . . . . . 0.418 ' H ' ' HB2' ' X' ' 7' ' ' LEU . . . 174.45 -154.72 19.65 Favored Glycine 0 CA--C 1.534 1.27 0 N-CA-C 110.871 -0.891 . . . . 0.0 110.871 -179.777 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 15' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -134.24 151.01 51.07 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 120.677 0.275 . . . . 0.0 110.297 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 2.7 m -147.68 129.43 15.17 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.027 178.838 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' X' X ' 17' ' ' THR . . . . . 0.523 HG23 ' O ' ' X' ' 3' ' ' TYR . 2.0 m -130.77 158.57 39.78 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 120.903 0.382 . . . . 0.0 110.818 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 18' ' ' THR . . . . . . . . . . . . . 6.3 t -154.25 153.29 31.48 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.463 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' X' X ' 19' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -103.85 113.12 26.41 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 179.653 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' X' X ' 20' ' ' ALA . . . . . . . . . . . . . . . -137.34 161.09 37.22 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.018 -179.544 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' X' X ' 21' ' ' VAL . . . . . 0.454 ' H ' HG12 ' X' ' 21' ' ' VAL . 1.1 p -80.83 -39.82 18.3 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.335 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.58 179.331 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 22' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -116.94 156.79 26.81 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.999 -179.432 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' X' X ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.77 -41.31 60.29 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.962 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' X' X ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.18 -36.37 83.86 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.617 -179.126 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' X' X ' 25' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -70.23 -31.77 69.34 Favored 'General case' 0 C--N 1.345 0.384 0 O-C-N 122.091 -0.381 . . . . 0.0 110.795 -179.609 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.03 -35.52 78.4 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.974 0.416 . . . . 0.0 110.703 -179.825 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' X' X ' 27' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -57.61 -29.04 64.19 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.866 -179.565 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 28' ' ' LYS . . . . . . . . . . . . . 41.0 mtmt -56.0 -42.41 76.34 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 120.391 -0.524 . . . . 0.0 110.497 -178.685 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' X' X ' 29' ' ' VAL . . . . . . . . . . . . . 12.1 t -70.12 -51.16 41.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-O 120.889 0.376 . . . . 0.0 110.505 179.283 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' X' X ' 30' ' ' PHE . . . . . . . . . . . . . 60.2 m-85 -61.97 -42.43 99.12 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.971 -179.29 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' X' X ' 31' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -63.06 -51.31 67.17 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 120.738 -0.385 . . . . 0.0 111.075 -179.305 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 32' ' ' GLN . . . . . 0.408 ' O ' ' OD1' ' X' ' 36' ' ' ASP . 79.6 mt-30 -72.09 -32.86 67.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.139 -179.489 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 33' ' ' TYR . . . . . . . . . . . . . 29.1 t80 -60.9 -34.79 75.21 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.873 -179.406 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' X' X ' 34' ' ' ALA . . . . . 0.606 ' HB1' ' O ' ' X' ' 39' ' ' VAL . . . -59.9 -43.55 94.76 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.33 -179.414 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 35' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -66.84 -36.22 81.83 Favored 'General case' 0 N--CA 1.447 -0.621 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 179.4 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 36' ' ' ASP . . . . . 0.494 ' N ' ' OD1' ' X' ' 36' ' ' ASP . 0.7 OUTLIER -67.38 -31.05 71.02 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.893 -179.857 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' X' X ' 37' ' ' ASN . . . . . 0.608 HD21 ' CG1' ' X' ' 39' ' ' VAL . 15.8 p-10 -95.57 -24.58 16.54 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 111.951 0.352 . . . . 0.0 111.951 -178.528 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 38' ' ' GLY . . . . . 0.533 ' N ' ' OD1' ' X' ' 37' ' ' ASN . . . 121.24 -41.06 1.97 Allowed Glycine 0 CA--C 1.532 1.155 0 C-N-CA 121.308 -0.472 . . . . 0.0 113.514 177.957 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 39' ' ' VAL . . . . . 0.608 ' CG1' HD21 ' X' ' 37' ' ' ASN . 1.5 p -80.19 108.57 13.77 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.325 0 CA-C-N 117.735 0.767 . . . . 0.0 111.597 -178.149 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 40' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -127.74 111.54 13.79 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.881 179.084 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' X' X ' 41' ' ' GLY . . . . . 0.513 ' H ' ' CG2' ' X' ' 54' ' ' VAL . . . -141.48 -156.07 6.69 Favored Glycine 0 CA--C 1.534 1.232 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.077 -179.501 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 42' ' ' GLU . . . . . 0.604 ' CD ' ' H ' ' X' ' 42' ' ' GLU . 2.5 mp0 -75.14 139.12 42.5 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-O 120.743 0.306 . . . . 0.0 110.251 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 43' ' ' TRP . . . . . . . . . . . . . 81.3 m95 -103.86 163.47 12.33 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.866 0.841 . . . . 0.0 112.679 -178.262 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' X' X ' 44' ' ' THR . . . . . 0.48 ' CG2' ' OG1' ' X' ' 53' ' ' THR . 10.4 t -156.98 167.07 31.57 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 114.125 -1.398 . . . . 0.0 108.341 178.955 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 45' ' ' TYR . . . . . 0.623 ' CE1' ' CE1' ' X' ' 52' ' ' PHE . 27.5 t80 -171.72 135.44 0.87 Allowed 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 119.603 -0.839 . . . . 0.0 111.858 -179.935 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 46' ' ' ASP . . . . . . . . . . . . . 11.7 t0 -123.29 112.44 17.63 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 177.785 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' X' X ' 47' ' ' ASP . . . . . . . . . . . . . 49.2 t0 -64.6 -15.67 61.5 Favored 'General case' 0 C--N 1.334 -0.076 0 CA-C-N 116.661 -0.245 . . . . 0.0 111.518 -179.143 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' X' X ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.99 -36.15 36.42 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 120.872 -0.331 . . . . 0.0 111.538 -179.494 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' X' X ' 49' ' ' THR . . . . . . . . . . . . . 2.8 p -102.84 2.91 36.04 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 110.632 -0.136 . . . . 0.0 110.632 -179.534 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' X' X ' 50' ' ' LYS . . . . . . . . . . . . . 14.0 mmmt 41.89 56.53 3.43 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 120.68 0.276 . . . . 0.0 110.412 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' X' X ' 51' ' ' THR . . . . . . . . . . . . . 39.0 m -144.32 129.49 18.67 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 -179.241 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' X' X ' 52' ' ' PHE . . . . . 0.623 ' CE1' ' CE1' ' X' ' 45' ' ' TYR . 53.1 m-85 -108.31 153.77 22.76 Favored 'General case' 0 C--N 1.344 0.342 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 178.524 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 53' ' ' THR . . . . . 0.48 ' OG1' ' CG2' ' X' ' 44' ' ' THR . 65.9 p -151.23 130.12 12.47 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 120.522 -0.471 . . . . 0.0 110.476 179.185 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 54' ' ' VAL . . . . . 0.513 ' CG2' ' H ' ' X' ' 41' ' ' GLY . 11.2 p -113.53 123.98 69.72 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 179.21 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 55' ' ' THR . . . . . 0.516 HG23 ' O ' ' X' ' 55' ' ' THR . 4.2 t -125.34 120.68 31.81 Favored 'General case' 0 N--CA 1.474 0.725 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.351 -178.719 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 56' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 . . . . . 0 C--O 1.22 -0.463 0 CA-C-O 117.983 -1.008 . . . . 0.0 110.027 179.607 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' X' X ' 1' ' ' MET . . . . . 0.589 ' SD ' ' CZ ' ' X' ' 3' ' ' TYR . 0.1 OUTLIER . . . . . 0 N--CA 1.493 1.685 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 2' ' ' GLN . . . . . . . . . . . . . 29.7 mt-30 -125.6 147.96 49.12 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 121.162 0.506 . . . . 0.0 111.072 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 3' ' ' TYR . . . . . 0.589 ' CZ ' ' SD ' ' X' ' 1' ' ' MET . 72.8 m-85 -115.66 143.1 45.84 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.447 179.341 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 4' ' ' LYS . . . . . . . . . . . . . 45.7 tttp -119.6 127.14 52.67 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 120.964 0.412 . . . . 0.0 110.331 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 5' ' ' LEU . . . . . 0.698 ' C ' HD13 ' X' ' 5' ' ' LEU . 1.0 OUTLIER -107.59 127.11 53.35 Favored 'General case' 0 N--CA 1.465 0.276 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 179.471 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' X' X ' 6' ' ' ILE . . . . . 0.535 ' N ' HD22 ' X' ' 5' ' ' LEU . 27.2 mm -98.43 132.91 42.59 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.493 0 CA-C-O 121.231 0.539 . . . . 0.0 109.78 -179.365 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 7' ' ' LEU . . . . . 0.453 HD23 HD22 ' X' ' 12' ' ' LEU . 6.0 mp -91.83 107.72 19.41 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.848 -178.617 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 8' ' ' ASN . . . . . 0.492 ' ND2' ' O ' ' X' ' 54' ' ' VAL . 1.7 p-10 -125.76 85.85 2.45 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 107.045 -1.465 . . . . 0.0 107.045 176.914 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 9' ' ' GLY . . . . . 0.69 ' C ' ' HZ1' ' X' ' 13' ' ' LYS . . . -116.06 -162.67 13.26 Favored Glycine 0 C--N 1.334 0.439 0 N-CA-C 111.271 -0.732 . . . . 0.0 111.271 -178.785 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 10' ' ' LYS . . . . . . . . . . . . . 48.1 mttt -66.67 -54.5 22.47 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 120.523 -0.471 . . . . 0.0 110.753 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 11' ' ' THR . . . . . . . . . . . . . 42.6 p -130.88 -8.78 3.94 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 120.692 0.282 . . . . 0.0 111.208 179.843 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 12' ' ' LEU . . . . . 0.496 ' O ' ' NZ ' ' X' ' 13' ' ' LYS . 0.6 OUTLIER -95.93 114.69 26.44 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.107 -178.713 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' X' X ' 13' ' ' LYS . . . . . 0.69 ' HZ1' ' C ' ' X' ' 9' ' ' GLY . 0.3 OUTLIER -135.54 142.56 45.4 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-O 120.942 0.401 . . . . 0.0 110.723 179.66 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' X' X ' 14' ' ' GLY . . . . . 0.432 ' O ' ' OE1' ' X' ' 15' ' ' GLU . . . 174.27 -158.03 26.22 Favored Glycine 0 CA--C 1.533 1.205 0 N-CA-C 110.937 -0.865 . . . . 0.0 110.937 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 15' ' ' GLU . . . . . 0.432 ' OE1' ' O ' ' X' ' 14' ' ' GLY . 5.0 mm-40 -134.17 150.88 51.12 Favored 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 110.139 -0.319 . . . . 0.0 110.139 179.689 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 2.3 m -148.02 129.43 14.83 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.278 178.91 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 17' ' ' THR . . . . . 0.558 HG23 ' O ' ' X' ' 3' ' ' TYR . 2.4 m -131.44 157.36 43.67 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 120.878 0.37 . . . . 0.0 110.546 179.835 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 18' ' ' THR . . . . . . . . . . . . . 7.5 t -149.52 152.96 36.44 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.019 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 19' ' ' GLU . . . . . 0.422 ' OE2' ' O ' ' X' ' 1' ' ' MET . 0.0 OUTLIER -103.93 105.81 16.12 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 179.924 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' X' X ' 20' ' ' ALA . . . . . . . . . . . . . . . -131.56 161.61 32.24 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 121.16 0.505 . . . . 0.0 111.235 -179.189 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 21' ' ' VAL . . . . . . . . . . . . . 1.2 p -87.02 -37.4 11.14 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.222 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.48 179.314 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 22' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -111.33 156.0 22.22 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.927 -179.416 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.99 -46.16 37.12 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.03 179.806 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 24' ' ' ALA . . . . . . . . . . . . . . . -62.41 -39.75 94.28 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.473 -179.011 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 25' ' ' THR . . . . . . . . . . . . . 1.1 t -64.14 -31.95 73.33 Favored 'General case' 0 C--N 1.345 0.393 0 C-N-CA 120.73 -0.388 . . . . 0.0 110.622 -179.609 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.03 -35.87 78.98 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.901 0.381 . . . . 0.0 110.651 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 27' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -61.76 -28.38 69.4 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.567 -179.775 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 28' ' ' LYS . . . . . . . . . . . . . 83.4 mttt -56.93 -43.1 81.12 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.178 -178.986 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 29' ' ' VAL . . . . . 0.427 ' O ' ' CB ' ' X' ' 33' ' ' TYR . 13.8 t -69.99 -51.19 42.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.533 179.298 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 30' ' ' PHE . . . . . . . . . . . . . 61.0 m-85 -61.91 -43.18 99.38 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.873 -179.301 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 31' ' ' LYS . . . . . . . . . . . . . 2.7 tppt? -66.34 -47.74 72.5 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 120.534 -0.466 . . . . 0.0 110.52 -179.785 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 32' ' ' GLN . . . . . . . . . . . . . 57.8 tp60 -71.81 -33.72 68.76 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.657 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 33' ' ' TYR . . . . . 0.427 ' CB ' ' O ' ' X' ' 29' ' ' VAL . 19.1 t80 -61.38 -30.52 70.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.478 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 34' ' ' ALA . . . . . 0.886 ' HB1' ' O ' ' X' ' 39' ' ' VAL . . . -59.32 -39.29 82.61 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.638 -178.6 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 35' ' ' ASN . . . . . . . . . . . . . 39.3 t-20 -69.06 -34.84 75.81 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 120.505 -0.478 . . . . 0.0 109.759 179.446 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 36' ' ' ASP . . . . . 0.508 ' N ' ' OD1' ' X' ' 36' ' ' ASP . 0.7 OUTLIER -67.28 -35.3 79.21 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 115.709 -0.678 . . . . 0.0 112.104 -179.538 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' X' X ' 37' ' ' ASN . . . . . 0.519 ' OD1' ' N ' ' X' ' 38' ' ' GLY . 24.6 p-10 -95.37 -25.17 16.39 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 120.86 -0.336 . . . . 0.0 111.512 -178.877 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 38' ' ' GLY . . . . . 0.519 ' N ' ' OD1' ' X' ' 37' ' ' ASN . . . 103.17 28.57 6.07 Favored Glycine 0 CA--C 1.534 1.238 0 CA-C-O 119.473 -0.626 . . . . 0.0 114.172 177.165 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 39' ' ' VAL . . . . . 0.886 ' O ' ' HB1' ' X' ' 34' ' ' ALA . 2.4 m -122.77 113.33 37.75 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 CA-C-N 118.201 1.001 . . . . 0.0 110.569 178.749 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 40' ' ' ASP . . . . . . . . . . . . . 19.0 t0 -127.35 108.01 10.48 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 179.799 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -145.19 -165.68 11.34 Favored Glycine 0 CA--C 1.531 1.065 0 N-CA-C 111.485 -0.646 . . . . 0.0 111.485 179.8 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 42' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -75.61 125.14 28.45 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 121.023 0.439 . . . . 0.0 110.429 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 43' ' ' TRP . . . . . . . . . . . . . 79.2 m95 -91.79 161.45 14.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.543 0.687 . . . . 0.0 111.59 -179.46 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 44' ' ' THR . . . . . 0.472 ' CG2' ' OG1' ' X' ' 53' ' ' THR . 9.1 t -156.91 167.57 30.08 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 114.617 -1.174 . . . . 0.0 108.497 179.162 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 45' ' ' TYR . . . . . 0.636 ' CD1' ' CE1' ' X' ' 52' ' ' PHE . 14.7 t80 -171.08 133.61 0.89 Allowed 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 119.458 -0.897 . . . . 0.0 112.062 -179.787 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 46' ' ' ASP . . . . . . . . . . . . . 12.7 t0 -123.95 112.39 17.15 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 177.627 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 47' ' ' ASP . . . . . 0.408 ' OD1' ' O ' ' X' ' 47' ' ' ASP . 10.1 t70 -67.19 -16.74 64.49 Favored 'General case' 0 C--O 1.231 0.106 0 CA-C-O 120.656 0.265 . . . . 0.0 110.997 -179.413 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.31 -12.97 59.93 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.138 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 49' ' ' THR . . . . . . . . . . . . . 2.6 p -128.16 2.93 5.81 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 110.526 -0.175 . . . . 0.0 110.526 -179.833 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 50' ' ' LYS . . . . . . . . . . . . . 68.5 mmtt 41.57 58.62 2.68 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 120.827 -0.349 . . . . 0.0 110.571 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 51' ' ' THR . . . . . . . . . . . . . 91.1 m -148.47 127.55 12.82 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 112.302 0.482 . . . . 0.0 112.302 -179.282 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 52' ' ' PHE . . . . . 0.636 ' CE1' ' CD1' ' X' ' 45' ' ' TYR . 19.4 m-85 -107.9 155.38 20.35 Favored 'General case' 0 C--N 1.344 0.357 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 178.318 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 53' ' ' THR . . . . . 0.472 ' OG1' ' CG2' ' X' ' 44' ' ' THR . 68.6 p -152.48 130.04 11.48 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 120.454 -0.498 . . . . 0.0 110.682 179.464 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 54' ' ' VAL . . . . . 0.503 ' O ' HG13 ' X' ' 54' ' ' VAL . 11.5 p -113.81 123.74 69.77 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 178.72 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 55' ' ' THR . . . . . 0.463 HG23 ' O ' ' X' ' 55' ' ' THR . 5.0 t -121.74 125.02 45.6 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.319 -178.412 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 56' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 . . . . . 0 C--O 1.22 -0.484 0 CA-C-O 117.955 -1.022 . . . . 0.0 110.348 179.765 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' X' X ' 1' ' ' MET . . . . . 0.48 ' CE ' ' OH ' ' X' ' 3' ' ' TYR . 0.1 OUTLIER . . . . . 0 N--CA 1.493 1.717 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 2' ' ' GLN . . . . . . . . . . . . . 86.5 mt-30 -126.94 146.7 50.22 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 121.006 0.431 . . . . 0.0 110.936 -179.762 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 3' ' ' TYR . . . . . 0.54 ' O ' HG23 ' X' ' 17' ' ' THR . 60.6 m-85 -124.67 137.84 54.34 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.555 179.283 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 4' ' ' LYS . . . . . . . . . . . . . 10.0 ttmm -119.62 127.35 52.85 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 120.935 0.398 . . . . 0.0 110.303 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 5' ' ' LEU . . . . . 0.703 ' C ' HD13 ' X' ' 5' ' ' LEU . 1.0 OUTLIER -108.95 128.17 54.7 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 179.458 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' X' X ' 6' ' ' ILE . . . . . 0.547 ' N ' HD22 ' X' ' 5' ' ' LEU . 28.1 mm -98.45 132.12 44.2 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.485 0 CA-C-O 120.958 0.409 . . . . 0.0 109.954 -179.385 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 7' ' ' LEU . . . . . 0.408 ' HB2' ' H ' ' X' ' 14' ' ' GLY . 6.2 mp -92.16 112.54 24.51 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.246 -179.221 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 8' ' ' ASN . . . . . 0.558 ' N ' ' ND2' ' X' ' 8' ' ' ASN . 0.0 OUTLIER -132.58 87.51 2.42 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.199 -1.038 . . . . 0.0 108.199 178.214 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' X' X ' 9' ' ' GLY . . . . . 0.559 ' H ' ' NZ ' ' X' ' 13' ' ' LYS . . . -122.85 -158.01 10.09 Favored Glycine 0 C--N 1.335 0.523 0 N-CA-C 111.201 -0.759 . . . . 0.0 111.201 -178.905 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 10' ' ' LYS . . . . . . . . . . . . . 70.2 mttt -73.64 -47.42 40.19 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.785 -0.366 . . . . 0.0 111.239 -179.534 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 11' ' ' THR . . . . . . . . . . . . . 41.6 p -130.62 -15.8 3.47 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 -179.384 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 12' ' ' LEU . . . . . 0.635 ' C ' ' HZ3' ' X' ' 13' ' ' LYS . 0.4 OUTLIER -99.36 112.96 25.04 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 120.762 0.315 . . . . 0.0 111.449 -178.672 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' X' X ' 13' ' ' LYS . . . . . 0.635 ' HZ3' ' C ' ' X' ' 12' ' ' LEU . 0.3 OUTLIER -135.01 139.2 44.66 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.103 179.265 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' X' X ' 14' ' ' GLY . . . . . 0.408 ' H ' ' HB2' ' X' ' 7' ' ' LEU . . . 174.38 -154.75 19.82 Favored Glycine 0 CA--C 1.535 1.305 0 N-CA-C 110.861 -0.896 . . . . 0.0 110.861 -179.749 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 15' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -133.39 150.29 51.8 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 120.731 0.3 . . . . 0.0 110.446 179.845 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 2.8 m -148.06 129.42 14.78 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.328 178.927 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 17' ' ' THR . . . . . 0.54 HG23 ' O ' ' X' ' 3' ' ' TYR . 2.4 m -130.28 156.86 43.95 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 120.961 0.41 . . . . 0.0 110.728 179.794 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 18' ' ' THR . . . . . . . . . . . . . 7.5 t -148.97 153.3 37.74 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.86 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 19' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -103.93 105.63 15.88 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.217 -0.447 . . . . 0.0 109.88 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 20' ' ' ALA . . . . . . . . . . . . . . . -136.71 163.46 30.55 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.741 -179.639 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 21' ' ' VAL . . . . . 0.445 ' H ' HG12 ' X' ' 21' ' ' VAL . 1.1 p -89.81 -40.7 13.2 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.279 0 CA-C-N 115.883 -0.599 . . . . 0.0 109.389 179.291 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 22' ' ' ASP . . . . . . . . . . . . . 37.1 m-20 -103.69 155.11 18.83 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.413 -179.157 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 23' ' ' ALA . . . . . . . . . . . . . . . -75.16 -45.97 37.29 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.925 179.657 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.81 -39.87 95.26 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.454 -179.049 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 25' ' ' THR . . . . . . . . . . . . . 1.2 t -63.55 -34.06 76.96 Favored 'General case' 0 C--N 1.346 0.423 0 C-N-CA 120.617 -0.433 . . . . 0.0 110.607 -179.53 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.25 -35.86 78.57 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.945 0.403 . . . . 0.0 110.568 179.907 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 27' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -60.02 -29.32 68.42 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.812 -179.493 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 28' ' ' LYS . . . . . . . . . . . . . 41.2 mtmt -56.03 -41.97 75.8 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 120.416 -0.513 . . . . 0.0 110.416 -178.7 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 29' ' ' VAL . . . . . 0.428 ' O ' ' CB ' ' X' ' 33' ' ' TYR . 11.5 t -70.26 -51.71 36.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-O 120.984 0.421 . . . . 0.0 110.526 179.337 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 30' ' ' PHE . . . . . . . . . . . . . 57.6 m-85 -61.96 -42.9 99.64 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.986 -179.188 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 31' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -61.66 -51.25 69.22 Favored 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 120.494 -0.482 . . . . 0.0 110.73 -179.47 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 32' ' ' GLN . . . . . . . . . . . . . 45.0 tt0 -73.48 -35.93 65.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.285 -179.606 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 33' ' ' TYR . . . . . 0.428 ' CB ' ' O ' ' X' ' 29' ' ' VAL . 70.0 t80 -61.8 -46.1 91.0 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.552 -0.294 . . . . 0.0 111.09 -179.388 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 34' ' ' ALA . . . . . 0.477 ' HB1' ' O ' ' X' ' 39' ' ' VAL . . . -59.16 -41.37 88.21 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.609 -0.437 . . . . 0.0 110.049 -179.287 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 35' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -60.46 -43.5 96.84 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 178.701 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 36' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -66.99 -26.48 66.82 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.342 179.048 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 37' ' ' ASN . . . . . 0.469 HD21 ' HA ' ' X' ' 37' ' ' ASN . 0.1 OUTLIER -83.77 -25.89 30.1 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.867 -178.96 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' X' X ' 38' ' ' GLY . . . . . . . . . . . . . . . 114.8 -37.52 3.49 Favored Glycine 0 CA--C 1.531 1.038 0 C-N-CA 121.559 -0.353 . . . . 0.0 112.285 178.949 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 39' ' ' VAL . . . . . 0.477 ' O ' ' HB1' ' X' ' 34' ' ' ALA . 1.4 p -80.55 108.75 14.26 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.305 0 CA-C-N 117.333 0.567 . . . . 0.0 111.107 -179.123 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 40' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -127.28 110.89 13.3 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 115.846 -0.616 . . . . 0.0 109.816 179.325 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 41' ' ' GLY . . . . . 0.485 ' H ' ' CG2' ' X' ' 54' ' ' VAL . . . -141.37 -157.36 7.14 Favored Glycine 0 CA--C 1.533 1.174 0 C-N-CA 120.764 -0.731 . . . . 0.0 111.927 -179.485 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 42' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -75.12 133.05 41.61 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 120.877 0.37 . . . . 0.0 110.254 -179.777 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 43' ' ' TRP . . . . . . . . . . . . . 82.0 m95 -98.02 161.5 13.69 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.734 0.778 . . . . 0.0 112.078 -178.75 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 44' ' ' THR . . . . . 0.499 ' CG2' ' OG1' ' X' ' 53' ' ' THR . 2.5 t -157.07 169.1 25.58 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 114.348 -1.297 . . . . 0.0 108.818 179.381 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 45' ' ' TYR . . . . . 0.627 ' CD1' ' CE1' ' X' ' 52' ' ' PHE . 7.0 t80 -173.38 135.14 0.54 Allowed 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 119.801 -0.76 . . . . 0.0 111.7 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 46' ' ' ASP . . . . . 0.401 ' N ' ' CD1' ' X' ' 45' ' ' TYR . 8.5 t0 -123.56 112.42 17.43 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 115.269 -0.878 . . . . 0.0 108.648 177.955 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 47' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -66.51 -14.65 62.57 Favored 'General case' 0 C--N 1.334 -0.101 0 CA-C-O 120.825 0.345 . . . . 0.0 110.714 -179.547 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.82 -13.19 59.59 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.149 -179.885 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 49' ' ' THR . . . . . . . . . . . . . 3.0 p -129.03 4.29 5.31 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 112.138 0.421 . . . . 0.0 112.138 -178.977 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 50' ' ' LYS . . . . . 0.438 ' NZ ' ' SD ' ' X' ' 1' ' ' MET . 11.3 mmpt? 44.9 56.0 5.65 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 119.76 -0.776 . . . . 0.0 110.654 -179.694 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 51' ' ' THR . . . . . . . . . . . . . 36.6 m -149.91 130.0 13.55 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 112.519 0.563 . . . . 0.0 112.519 -179.015 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 52' ' ' PHE . . . . . 0.627 ' CE1' ' CD1' ' X' ' 45' ' ' TYR . 14.0 m-85 -110.89 154.3 24.25 Favored 'General case' 0 C--N 1.346 0.442 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 178.236 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 53' ' ' THR . . . . . 0.499 ' OG1' ' CG2' ' X' ' 44' ' ' THR . 47.5 p -150.95 131.14 13.54 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 120.333 -0.547 . . . . 0.0 110.472 179.151 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 54' ' ' VAL . . . . . 0.485 ' CG2' ' H ' ' X' ' 41' ' ' GLY . 10.8 p -113.48 124.31 69.99 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 179.176 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 55' ' ' THR . . . . . 0.532 HG23 ' O ' ' X' ' 55' ' ' THR . 4.7 t -124.82 120.99 33.28 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 116.4 -0.363 . . . . 0.0 111.445 -178.594 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 56' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 . . . . . 0 C--O 1.22 -0.459 0 CA-C-O 117.917 -1.04 . . . . 0.0 110.208 179.389 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' X' X ' 1' ' ' MET . . . . . 0.601 ' SD ' ' NZ ' ' X' ' 50' ' ' LYS . 0.2 OUTLIER . . . . . 0 N--CA 1.494 1.761 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 2' ' ' GLN . . . . . . . . . . . . . 92.7 mt-30 -127.7 138.34 52.76 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 120.998 0.427 . . . . 0.0 111.177 -179.491 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 3' ' ' TYR . . . . . 0.47 ' OH ' ' SD ' ' X' ' 1' ' ' MET . 64.5 m-85 -115.99 141.22 48.41 Favored 'General case' 0 CA--C 1.517 -0.308 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 178.733 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 4' ' ' LYS . . . . . . . . . . . . . 49.8 tttp -119.47 127.28 52.92 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 120.767 0.317 . . . . 0.0 110.34 -179.831 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 5' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -103.32 130.01 50.49 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.109 179.809 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 6' ' ' ILE . . . . . . . . . . . . . 32.6 mm -101.17 127.3 54.55 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.485 0 N-CA-C 109.349 -0.612 . . . . 0.0 109.349 178.07 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 7' ' ' LEU . . . . . 0.493 HD23 HD22 ' X' ' 12' ' ' LEU . 6.3 mp -93.45 112.11 23.93 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.502 -178.841 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 8' ' ' ASN . . . . . 0.558 ' OD1' ' N ' ' X' ' 8' ' ' ASN . 1.9 p-10 -134.59 87.61 2.37 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 178.237 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 9' ' ' GLY . . . . . 0.599 ' H ' ' NZ ' ' X' ' 13' ' ' LYS . . . -125.76 -157.4 9.6 Favored Glycine 0 C--N 1.336 0.543 0 N-CA-C 111.404 -0.678 . . . . 0.0 111.404 -178.971 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 10' ' ' LYS . . . . . . . . . . . . . 70.8 mttt -79.97 -49.18 12.21 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 121.059 -0.256 . . . . 0.0 111.543 -179.248 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 11' ' ' THR . . . . . . . . . . . . . 42.5 p -130.2 18.46 5.44 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -179.031 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 12' ' ' LEU . . . . . 0.794 ' H ' ' HZ1' ' X' ' 13' ' ' LYS . 0.4 OUTLIER -138.41 106.34 5.68 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 120.803 0.335 . . . . 0.0 110.905 -179.699 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' X' X ' 13' ' ' LYS . . . . . 0.794 ' HZ1' ' H ' ' X' ' 12' ' ' LEU . 0.2 OUTLIER -130.78 138.94 50.16 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.273 179.509 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' X' X ' 14' ' ' GLY . . . . . 0.427 ' O ' ' OE2' ' X' ' 15' ' ' GLU . . . 173.87 -155.4 21.79 Favored Glycine 0 CA--C 1.533 1.183 0 N-CA-C 111.158 -0.777 . . . . 0.0 111.158 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 15' ' ' GLU . . . . . 0.427 ' OE2' ' O ' ' X' ' 14' ' ' GLY . 6.6 mm-40 -134.11 151.98 51.63 Favored 'General case' 0 N--CA 1.465 0.291 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 179.609 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -147.75 141.67 25.85 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 179.142 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 17' ' ' THR . . . . . 0.451 HG23 ' O ' ' X' ' 3' ' ' TYR . 2.6 m -144.4 154.55 43.1 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 121.19 0.519 . . . . 0.0 110.978 179.651 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 18' ' ' THR . . . . . 0.52 HG22 ' CZ ' ' X' ' 30' ' ' PHE . 14.6 t -155.45 153.58 30.55 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.411 -179.845 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 19' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -103.65 105.61 15.89 Favored 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 179.791 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 20' ' ' ALA . . . . . . . . . . . . . . . -126.98 160.45 31.03 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.798 -179.678 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 21' ' ' VAL . . . . . 0.466 ' H ' HG12 ' X' ' 21' ' ' VAL . 1.0 OUTLIER -80.77 -41.4 19.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 N-CA-C 109.29 -0.634 . . . . 0.0 109.29 179.277 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' X' X ' 22' ' ' ASP . . . . . 0.42 ' OD1' ' N ' ' X' ' 22' ' ' ASP . 32.1 p-10 -127.99 161.47 29.08 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.573 -179.774 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.2 -35.19 63.93 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.028 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.63 -37.65 76.37 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.91 -178.794 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 25' ' ' THR . . . . . 0.402 ' CG2' ' OD1' ' X' ' 22' ' ' ASP . 1.5 t -75.23 -40.19 59.25 Favored 'General case' 0 C--N 1.345 0.376 0 CA-C-N 118.129 0.422 . . . . 0.0 111.239 -179.337 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.93 -35.58 78.67 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.849 0.356 . . . . 0.0 111.162 -179.448 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 27' ' ' GLU . . . . . 0.435 ' O ' ' CB ' ' X' ' 31' ' ' LYS . 1.6 pt-20 -59.59 -30.46 68.69 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.237 -179.235 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 28' ' ' LYS . . . . . . . . . . . . . 81.7 mttt -58.07 -48.83 78.93 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.307 -0.557 . . . . 0.0 110.326 -178.425 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 29' ' ' VAL . . . . . 0.43 ' O ' ' CB ' ' X' ' 33' ' ' TYR . 12.4 t -72.55 -51.72 27.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-O 121.189 0.518 . . . . 0.0 110.795 179.24 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 30' ' ' PHE . . . . . 0.52 ' CZ ' HG22 ' X' ' 18' ' ' THR . 4.6 m-30 -61.48 -43.18 99.33 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.828 -178.672 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 31' ' ' LYS . . . . . 0.435 ' CB ' ' O ' ' X' ' 27' ' ' GLU . 14.9 ttmt -66.65 -46.98 73.99 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.218 -0.593 . . . . 0.0 110.575 -179.892 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 32' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -73.49 -32.86 64.51 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.118 -179.862 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 33' ' ' TYR . . . . . 0.43 ' CB ' ' O ' ' X' ' 29' ' ' VAL . 58.1 t80 -60.66 -46.09 91.63 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.141 -178.922 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 34' ' ' ALA . . . . . 0.584 ' HB1' ' O ' ' X' ' 39' ' ' VAL . . . -60.17 -36.42 77.55 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.649 -0.421 . . . . 0.0 110.171 -179.733 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 35' ' ' ASN . . . . . . . . . . . . . 5.7 t30 -71.18 -44.49 65.35 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 179.416 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 36' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -67.39 -32.77 73.9 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.827 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 37' ' ' ASN . . . . . 0.563 ' OD1' ' N ' ' X' ' 38' ' ' GLY . 24.5 p30 -79.23 -24.3 43.16 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 120.474 -0.49 . . . . 0.0 111.328 -178.832 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 38' ' ' GLY . . . . . 0.563 ' N ' ' OD1' ' X' ' 37' ' ' ASN . . . 130.87 -44.41 1.21 Allowed Glycine 0 CA--C 1.532 1.134 0 C-N-CA 121.257 -0.497 . . . . 0.0 112.738 178.601 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 39' ' ' VAL . . . . . 0.584 ' O ' ' HB1' ' X' ' 34' ' ' ALA . 1.9 p -81.0 109.08 14.98 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 CA-C-N 117.403 0.601 . . . . 0.0 112.089 -178.114 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 40' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -128.19 111.02 12.98 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.49 178.813 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 41' ' ' GLY . . . . . 0.449 ' H ' ' CG2' ' X' ' 54' ' ' VAL . . . -143.52 -155.24 6.36 Favored Glycine 0 CA--C 1.533 1.202 0 C-N-CA 120.291 -0.957 . . . . 0.0 112.471 -179.298 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 42' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -74.37 141.64 45.13 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 -179.856 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 43' ' ' TRP . . . . . . . . . . . . . 83.6 m95 -104.99 162.37 13.41 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.897 0.856 . . . . 0.0 112.858 -177.829 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 44' ' ' THR . . . . . 0.498 ' CG2' ' OG1' ' X' ' 53' ' ' THR . 2.5 t -157.01 164.21 38.24 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 114.073 -1.421 . . . . 0.0 108.828 179.339 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 45' ' ' TYR . . . . . 0.62 ' CD1' ' CE1' ' X' ' 52' ' ' PHE . 3.0 t80 -175.03 134.53 0.34 Allowed 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 119.701 -0.8 . . . . 0.0 111.666 179.862 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 46' ' ' ASP . . . . . 0.514 ' N ' ' CD1' ' X' ' 45' ' ' TYR . 11.2 t0 -123.74 112.56 17.49 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 115.186 -0.916 . . . . 0.0 108.699 177.978 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 47' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -65.81 -15.63 63.06 Favored 'General case' 0 C--O 1.231 0.079 0 CA-C-O 120.698 0.285 . . . . 0.0 110.918 -179.674 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.33 -13.67 59.49 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.069 -179.729 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 49' ' ' THR . . . . . . . . . . . . . 2.7 p -128.29 3.14 5.73 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 121.436 -0.106 . . . . 0.0 110.725 -179.657 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 50' ' ' LYS . . . . . 0.601 ' NZ ' ' SD ' ' X' ' 1' ' ' MET . 68.6 mmtt 41.18 56.39 3.07 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 120.839 -0.344 . . . . 0.0 110.632 -179.938 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 51' ' ' THR . . . . . . . . . . . . . 96.8 m -144.16 127.02 16.29 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 120.671 0.272 . . . . 0.0 111.456 -179.409 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 52' ' ' PHE . . . . . 0.62 ' CE1' ' CD1' ' X' ' 45' ' ' TYR . 15.9 m-85 -109.44 153.93 23.34 Favored 'General case' 0 C--N 1.343 0.295 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 179.109 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 53' ' ' THR . . . . . 0.498 ' OG1' ' CG2' ' X' ' 44' ' ' THR . 4.3 p -152.23 129.3 11.09 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 120.493 -0.483 . . . . 0.0 109.989 178.82 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 54' ' ' VAL . . . . . 0.473 ' O ' HG13 ' X' ' 54' ' ' VAL . 14.4 p -112.84 124.2 69.25 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 178.48 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 55' ' ' THR . . . . . 0.431 ' O ' HG23 ' X' ' 55' ' ' THR . 2.0 t -124.55 124.49 42.38 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.651 -178.085 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 56' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 . . . . . 0 C--O 1.221 -0.402 0 CA-C-O 117.968 -1.015 . . . . 0.0 110.09 179.465 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' X' X ' 1' ' ' MET . . . . . 0.54 ' SD ' ' NZ ' ' X' ' 50' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.706 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 . . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 2' ' ' GLN . . . . . . . . . . . . . 16.0 pt20 -127.91 142.27 51.31 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.879 0.371 . . . . 0.0 110.756 -179.827 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 3' ' ' TYR . . . . . 0.537 ' O ' HG23 ' X' ' 17' ' ' THR . 92.0 m-85 -115.81 148.44 39.89 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.9 -0.591 . . . . 0.0 109.627 179.379 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 4' ' ' LYS . . . . . . . . . . . . . 45.5 tttp -119.27 127.81 53.58 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 120.927 0.394 . . . . 0.0 110.259 179.842 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 5' ' ' LEU . . . . . 0.706 ' C ' HD13 ' X' ' 5' ' ' LEU . 1.1 tm? -109.72 127.83 54.86 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.403 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 6' ' ' ILE . . . . . 0.518 ' N ' HD22 ' X' ' 5' ' ' LEU . 26.8 mm -98.91 132.34 44.41 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.349 0 CA-C-O 120.901 0.381 . . . . 0.0 110.15 -179.361 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 7' ' ' LEU . . . . . 0.435 HD21 HD22 ' X' ' 37' ' ' ASN . 6.3 mp -92.42 110.75 22.16 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.649 -179.131 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 8' ' ' ASN . . . . . 0.469 ' OD1' ' N ' ' X' ' 8' ' ' ASN . 6.3 p-10 -134.57 87.68 2.37 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 178.034 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 9' ' ' GLY . . . . . 0.821 ' H ' ' HZ1' ' X' ' 13' ' ' LYS . . . -123.89 -143.5 6.26 Favored Glycine 0 N--CA 1.464 0.552 0 N-CA-C 111.662 -0.575 . . . . 0.0 111.662 -179.158 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 10' ' ' LYS . . . . . . . . . . . . . 74.1 mttt -87.98 -53.17 4.87 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 111.818 0.303 . . . . 0.0 111.818 -179.274 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 11' ' ' THR . . . . . . . . . . . . . 41.4 p -130.29 21.83 5.23 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 -178.907 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 12' ' ' LEU . . . . . 0.777 ' C ' ' HZ2' ' X' ' 13' ' ' LYS . 0.6 OUTLIER -138.56 116.98 12.0 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 120.707 0.289 . . . . 0.0 110.725 -179.95 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' X' X ' 13' ' ' LYS . . . . . 0.821 ' HZ1' ' H ' ' X' ' 9' ' ' GLY . 0.3 OUTLIER -138.88 139.72 38.17 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.009 0.433 . . . . 0.0 110.749 179.889 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' X' X ' 14' ' ' GLY . . . . . 0.439 ' O ' ' OE1' ' X' ' 15' ' ' GLU . . . 174.17 -155.24 21.15 Favored Glycine 0 CA--C 1.533 1.17 0 N-CA-C 110.624 -0.991 . . . . 0.0 110.624 -179.913 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 15' ' ' GLU . . . . . 0.439 ' OE1' ' O ' ' X' ' 14' ' ' GLY . 5.2 mm-40 -133.83 150.87 51.42 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.863 0.332 . . . . 0.0 110.166 179.684 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 2.8 m -147.9 129.22 14.77 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 120.776 -0.37 . . . . 0.0 110.159 179.006 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 17' ' ' THR . . . . . 0.537 HG23 ' O ' ' X' ' 3' ' ' TYR . 2.5 m -130.69 156.79 44.33 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 120.989 0.423 . . . . 0.0 110.544 179.895 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 18' ' ' THR . . . . . . . . . . . . . 7.6 t -148.91 152.88 37.17 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 115.881 -0.599 . . . . 0.0 109.545 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 19' ' ' GLU . . . . . 0.422 ' OE2' ' O ' ' X' ' 1' ' ' MET . 1.1 tm-20 -104.21 105.55 15.73 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 -179.679 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 20' ' ' ALA . . . . . 0.419 ' O ' ' O ' ' X' ' 1' ' ' MET . . . -136.66 163.12 31.32 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.69 -179.579 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 21' ' ' VAL . . . . . 0.453 ' H ' HG12 ' X' ' 21' ' ' VAL . 1.1 p -88.56 -40.78 13.69 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.595 179.26 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 22' ' ' ASP . . . . . 0.426 ' OD1' ' N ' ' X' ' 23' ' ' ALA . 46.5 t0 -103.61 154.41 19.53 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.376 -179.247 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 23' ' ' ALA . . . . . 0.426 ' N ' ' OD1' ' X' ' 22' ' ' ASP . . . -75.08 -43.35 53.61 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.87 179.599 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.34 -39.79 94.59 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.595 -179.148 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 25' ' ' THR . . . . . . . . . . . . . 1.2 t -64.11 -34.2 77.51 Favored 'General case' 0 C--N 1.345 0.405 0 C-N-CA 120.665 -0.414 . . . . 0.0 110.572 -179.732 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.43 -35.88 78.26 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.877 0.37 . . . . 0.0 110.777 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 27' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -61.58 -28.02 69.05 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.859 -179.6 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 28' ' ' LYS . . . . . . . . . . . . . 83.8 mttt -56.8 -44.27 81.77 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.535 -0.466 . . . . 0.0 110.003 -179.025 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 29' ' ' VAL . . . . . 0.429 ' O ' ' CB ' ' X' ' 33' ' ' TYR . 11.5 t -70.15 -50.92 43.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.647 179.289 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 30' ' ' PHE . . . . . . . . . . . . . 55.0 m-85 -61.8 -43.53 98.67 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.111 -0.495 . . . . 0.0 112.009 -179.019 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 31' ' ' LYS . . . . . . . . . . . . . 67.5 mttt -70.47 -40.94 73.37 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 120.215 -0.594 . . . . 0.0 110.386 -179.627 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 32' ' ' GLN . . . . . . . . . . . . . 3.6 tp-100 -73.17 -33.55 65.52 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 179.168 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 33' ' ' TYR . . . . . 0.429 ' CB ' ' O ' ' X' ' 29' ' ' VAL . 29.2 t80 -66.76 -36.83 83.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.877 -179.848 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 34' ' ' ALA . . . . . 0.509 ' HB1' ' O ' ' X' ' 39' ' ' VAL . . . -59.38 -41.83 90.28 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.492 -179.188 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 35' ' ' ASN . . . . . . . . . . . . . 13.3 t-20 -66.67 -37.68 85.27 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 179.209 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 36' ' ' ASP . . . . . 0.491 ' N ' ' OD1' ' X' ' 36' ' ' ASP . 0.9 OUTLIER -67.71 -33.15 74.31 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.404 -0.816 . . . . 0.0 111.938 -179.908 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' X' X ' 37' ' ' ASN . . . . . 0.605 HD21 ' CG1' ' X' ' 39' ' ' VAL . 14.8 p-10 -90.59 -24.57 20.52 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 120.766 -0.374 . . . . 0.0 111.883 -178.301 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 38' ' ' GLY . . . . . 0.535 ' N ' ' OD1' ' X' ' 37' ' ' ASN . . . 118.92 -39.2 2.61 Favored Glycine 0 CA--C 1.533 1.2 0 C-N-CA 121.228 -0.51 . . . . 0.0 113.806 177.752 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 39' ' ' VAL . . . . . 0.605 ' CG1' HD21 ' X' ' 37' ' ' ASN . 1.5 p -80.24 108.29 13.51 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 CA-C-N 117.974 0.887 . . . . 0.0 111.549 -178.042 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 40' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -127.78 111.94 14.21 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 115.762 -0.654 . . . . 0.0 109.861 179.143 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 41' ' ' GLY . . . . . 0.524 ' H ' ' CG2' ' X' ' 54' ' ' VAL . . . -141.82 -154.96 6.3 Favored Glycine 0 CA--C 1.534 1.223 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.149 -179.464 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 42' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -74.98 137.34 41.5 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 110.092 -0.336 . . . . 0.0 110.092 -179.789 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 43' ' ' TRP . . . . . . . . . . . . . 82.1 m95 -102.97 161.88 13.39 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.767 0.794 . . . . 0.0 112.611 -178.45 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 44' ' ' THR . . . . . 0.481 ' CG2' ' OG1' ' X' ' 53' ' ' THR . 11.3 t -157.01 169.04 25.74 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.181 -1.372 . . . . 0.0 108.368 179.251 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 45' ' ' TYR . . . . . 0.612 ' CD1' ' CE1' ' X' ' 52' ' ' PHE . 3.0 t80 -174.43 135.27 0.42 Allowed 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 119.597 -0.841 . . . . 0.0 111.819 -179.951 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 46' ' ' ASP . . . . . 0.517 ' N ' ' CD1' ' X' ' 45' ' ' TYR . 14.8 t0 -123.68 112.5 17.46 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 115.206 -0.907 . . . . 0.0 108.804 177.989 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 47' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -66.56 -14.94 63.01 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-O 120.775 0.321 . . . . 0.0 110.831 -179.789 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.34 -14.53 58.92 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.082 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 49' ' ' THR . . . . . . . . . . . . . 2.7 p -128.27 3.33 5.74 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 121.475 -0.09 . . . . 0.0 110.888 -179.737 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 50' ' ' LYS . . . . . 0.54 ' NZ ' ' SD ' ' X' ' 1' ' ' MET . 68.7 mmtt 41.63 56.7 3.25 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 120.799 -0.36 . . . . 0.0 110.546 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 51' ' ' THR . . . . . . . . . . . . . 86.3 m -146.24 127.84 15.15 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 120.775 0.322 . . . . 0.0 111.828 -179.303 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 52' ' ' PHE . . . . . 0.612 ' CE1' ' CD1' ' X' ' 45' ' ' TYR . 11.0 m-85 -108.2 155.29 20.62 Favored 'General case' 0 C--N 1.343 0.301 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 178.725 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 53' ' ' THR . . . . . 0.481 ' OG1' ' CG2' ' X' ' 44' ' ' THR . 58.8 p -150.97 130.54 13.02 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 120.513 -0.475 . . . . 0.0 110.396 179.277 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 54' ' ' VAL . . . . . 0.524 ' CG2' ' H ' ' X' ' 41' ' ' GLY . 11.4 p -113.58 123.89 69.68 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.408 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 179.243 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 55' ' ' THR . . . . . 0.52 HG23 ' O ' ' X' ' 55' ' ' THR . 4.2 t -125.31 120.39 31.03 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.403 -178.715 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 56' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 . . . . . 0 C--O 1.219 -0.517 0 CA-C-O 118.117 -0.944 . . . . 0.0 110.094 179.567 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' X' X ' 1' ' ' MET . . . . . 0.434 ' O ' ' OE2' ' X' ' 19' ' ' GLU . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.609 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 2' ' ' GLN . . . . . . . . . . . . . 80.0 mt-30 -126.85 139.19 53.27 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 120.961 0.41 . . . . 0.0 111.312 -179.497 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 3' ' ' TYR . . . . . 0.636 ' CD1' ' N ' ' X' ' 3' ' ' TYR . 0.1 OUTLIER -119.87 168.74 10.81 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 178.866 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' X' X ' 4' ' ' LYS . . . . . . . . . . . . . 28.7 tttm -135.86 128.78 31.29 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 121.062 -0.255 . . . . 0.0 110.566 -179.829 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 5' ' ' LEU . . . . . 0.573 HD22 ' N ' ' X' ' 6' ' ' ILE . 1.7 tm? -105.79 126.26 51.96 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 179.633 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 6' ' ' ILE . . . . . 0.573 ' N ' HD22 ' X' ' 5' ' ' LEU . 32.9 mm -98.14 132.54 42.91 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.452 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 179.393 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 7' ' ' LEU . . . . . 0.502 HD23 HD22 ' X' ' 12' ' ' LEU . 5.7 mp -92.21 115.25 27.92 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.652 -179.536 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 8' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 -134.55 87.52 2.36 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 177.863 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 9' ' ' GLY . . . . . 0.529 ' H ' ' HD3' ' X' ' 13' ' ' LYS . . . -126.85 -163.0 11.37 Favored Glycine 0 C--N 1.336 0.541 0 N-CA-C 111.291 -0.724 . . . . 0.0 111.291 -179.096 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 10' ' ' LYS . . . . . . . . . . . . . 40.5 mtmt -80.55 -43.02 21.34 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.938 -0.305 . . . . 0.0 110.937 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 11' ' ' THR . . . . . . . . . . . . . 42.3 p -130.54 15.78 5.43 Favored 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 112.3 0.482 . . . . 0.0 112.3 -179.195 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 12' ' ' LEU . . . . . 0.664 ' N ' ' HZ2' ' X' ' 13' ' ' LYS . 0.3 OUTLIER -138.52 100.44 4.09 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 120.842 -0.343 . . . . 0.0 111.642 -179.526 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' X' X ' 13' ' ' LYS . . . . . 0.664 ' HZ2' ' N ' ' X' ' 12' ' ' LEU . 0.0 OUTLIER -122.44 137.77 54.76 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 178.829 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' X' X ' 14' ' ' GLY . . . . . . . . . . . . . . . 173.17 -154.6 20.85 Favored Glycine 0 CA--C 1.533 1.184 0 N-CA-C 111.082 -0.807 . . . . 0.0 111.082 -179.73 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 15' ' ' GLU . . . . . . . . . . . . . 56.8 mm-40 -131.8 152.74 50.76 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.595 0.236 . . . . 0.0 110.469 179.613 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -148.23 154.85 40.62 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 120.969 0.414 . . . . 0.0 110.441 179.716 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 17' ' ' THR . . . . . 0.594 HG23 ' O ' ' X' ' 3' ' ' TYR . 2.0 m -145.96 158.93 43.86 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.737 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 18' ' ' THR . . . . . . . . . . . . . 4.4 t -153.08 151.2 29.94 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-N 116.203 -0.453 . . . . 0.0 109.885 179.069 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 19' ' ' GLU . . . . . 0.434 ' OE2' ' O ' ' X' ' 1' ' ' MET . 0.8 OUTLIER -106.55 110.81 23.12 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.089 179.769 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' X' X ' 20' ' ' ALA . . . . . . . . . . . . . . . -147.57 162.12 39.75 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.055 0.455 . . . . 0.0 110.597 179.766 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 21' ' ' VAL . . . . . 0.448 HG12 ' H ' ' X' ' 21' ' ' VAL . 1.1 p -87.0 -41.38 14.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.717 179.561 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 22' ' ' ASP . . . . . . . . . . . . . 68.6 m-20 -103.86 151.82 22.66 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.482 -179.033 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.43 -37.46 63.31 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.298 -0.864 . . . . 0.0 110.872 179.735 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 24' ' ' ALA . . . . . . . . . . . . . . . -70.49 -38.23 74.33 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.332 -179.197 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 25' ' ' THR . . . . . . . . . . . . . 1.1 t -67.29 -29.82 69.52 Favored 'General case' 0 C--N 1.345 0.408 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.621 -179.835 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.55 -35.77 79.69 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.495 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 27' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -58.31 -30.4 66.63 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.579 -179.771 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 28' ' ' LYS . . . . . . . . . . . . . 41.7 mtmt -57.34 -39.52 76.09 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.472 -0.491 . . . . 0.0 110.181 -178.948 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 29' ' ' VAL . . . . . 0.415 ' O ' ' CB ' ' X' ' 33' ' ' TYR . 13.0 t -70.02 -51.47 39.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.543 179.33 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 30' ' ' PHE . . . . . . . . . . . . . 40.8 m-85 -64.59 -42.97 95.25 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.859 -179.412 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 31' ' ' LYS . . . . . . . . . . . . . 2.8 tppt? -61.46 -49.2 77.75 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 120.282 -0.567 . . . . 0.0 110.78 -179.478 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 32' ' ' GLN . . . . . . . . . . . . . 89.6 mt-30 -73.08 -38.36 66.44 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.838 -179.746 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 33' ' ' TYR . . . . . 0.676 ' CZ ' ' ND2' ' X' ' 37' ' ' ASN . 69.8 t80 -61.8 -37.47 84.51 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.645 -179.797 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 34' ' ' ALA . . . . . 0.474 ' HB1' ' O ' ' X' ' 39' ' ' VAL . . . -59.27 -38.06 79.17 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.39 -179.325 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 35' ' ' ASN . . . . . . . . . . . . . 10.0 m-20 -61.18 -48.17 82.78 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 179.504 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 36' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -66.81 -24.7 66.2 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.02 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 37' ' ' ASN . . . . . 0.676 ' ND2' ' CZ ' ' X' ' 33' ' ' TYR . 0.5 OUTLIER -87.27 -26.08 23.63 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 116.471 -0.332 . . . . 0.0 110.996 -178.943 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' X' X ' 38' ' ' GLY . . . . . . . . . . . . . . . 106.08 -36.91 4.1 Favored Glycine 0 CA--C 1.53 1.019 0 C-N-CA 121.359 -0.448 . . . . 0.0 112.563 178.626 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 39' ' ' VAL . . . . . 0.474 ' O ' ' HB1' ' X' ' 34' ' ' ALA . 3.1 p -79.96 107.74 12.68 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.39 0 CA-C-N 117.575 0.687 . . . . 0.0 110.983 -179.096 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 40' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -128.12 110.83 12.83 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.888 179.358 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 41' ' ' GLY . . . . . 0.513 ' H ' ' CG2' ' X' ' 54' ' ' VAL . . . -141.86 -155.72 6.56 Favored Glycine 0 CA--C 1.531 1.064 0 C-N-CA 120.683 -0.77 . . . . 0.0 111.943 -179.69 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 42' ' ' GLU . . . . . . . . . . . . . 10.9 mt-10 -74.99 133.62 41.65 Favored 'General case' 0 N--CA 1.446 -0.631 0 N-CA-C 110.129 -0.323 . . . . 0.0 110.129 -179.803 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 43' ' ' TRP . . . . . . . . . . . . . 90.6 m95 -99.19 162.36 13.1 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.476 0.655 . . . . 0.0 111.892 -178.541 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 44' ' ' THR . . . . . 0.507 ' CG2' ' OG1' ' X' ' 53' ' ' THR . 2.5 t -156.9 167.11 31.46 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 114.845 -1.071 . . . . 0.0 109.492 179.783 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 45' ' ' TYR . . . . . 0.63 ' CD1' ' CZ ' ' X' ' 52' ' ' PHE . 64.7 t80 -166.52 136.7 3.24 Favored 'General case' 0 CA--C 1.519 -0.241 0 C-N-CA 120.116 -0.634 . . . . 0.0 111.958 179.739 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 46' ' ' ASP . . . . . . . . . . . . . 18.8 t0 -123.44 111.79 16.76 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 177.523 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 47' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -67.11 -15.74 63.9 Favored 'General case' 0 C--O 1.231 0.095 0 CA-C-O 120.882 0.372 . . . . 0.0 110.751 -179.708 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.35 -18.09 53.17 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.115 -179.698 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 49' ' ' THR . . . . . . . . . . . . . 2.6 p -128.2 2.74 5.79 Favored 'General case' 0 N--CA 1.469 0.521 0 N-CA-C 110.626 -0.139 . . . . 0.0 110.626 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 50' ' ' LYS . . . . . . . . . . . . . 65.7 mmtt 39.64 55.69 2.39 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-O 120.583 0.23 . . . . 0.0 110.712 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 51' ' ' THR . . . . . . . . . . . . . 99.7 m -138.31 129.65 27.48 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.018 -179.6 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 52' ' ' PHE . . . . . 0.63 ' CZ ' ' CD1' ' X' ' 45' ' ' TYR . 87.3 m-85 -107.29 154.26 21.52 Favored 'General case' 0 C--N 1.342 0.281 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 179.46 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 53' ' ' THR . . . . . 0.507 ' OG1' ' CG2' ' X' ' 44' ' ' THR . 24.2 p -151.9 130.44 12.23 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 120.599 -0.44 . . . . 0.0 110.253 178.956 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 54' ' ' VAL . . . . . 0.513 ' CG2' ' H ' ' X' ' 41' ' ' GLY . 10.6 p -113.42 123.7 69.33 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 178.871 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 55' ' ' THR . . . . . 0.538 HG23 ' O ' ' X' ' 55' ' ' THR . 4.8 t -125.35 120.7 31.84 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.511 -178.425 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 56' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 . . . . . 0 C--O 1.22 -0.461 0 CA-C-O 118.073 -0.965 . . . . 0.0 110.136 179.252 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' X' X ' 1' ' ' MET . . . . . 0.596 ' SD ' ' CZ ' ' X' ' 3' ' ' TYR . 0.7 OUTLIER . . . . . 0 N--CA 1.493 1.685 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 . . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 2' ' ' GLN . . . . . . . . . . . . . 15.5 mm-40 -113.33 134.13 54.78 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.049 0.452 . . . . 0.0 110.92 -179.335 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 3' ' ' TYR . . . . . 0.596 ' CZ ' ' SD ' ' X' ' 1' ' ' MET . 38.1 m-85 -125.61 137.01 53.87 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.771 -0.65 . . . . 0.0 109.412 179.17 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 4' ' ' LYS . . . . . . . . . . . . . 44.8 tttp -119.97 128.06 53.22 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 120.923 0.392 . . . . 0.0 110.703 -179.821 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 5' ' ' LEU . . . . . 0.71 ' C ' HD13 ' X' ' 5' ' ' LEU . 1.0 OUTLIER -109.29 127.94 54.69 Favored 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 179.435 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' X' X ' 6' ' ' ILE . . . . . 0.537 ' N ' HD22 ' X' ' 5' ' ' LEU . 27.0 mm -98.99 132.35 44.51 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 CA-C-O 120.948 0.404 . . . . 0.0 110.176 -179.386 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 7' ' ' LEU . . . . . 0.406 ' HB2' ' H ' ' X' ' 14' ' ' GLY . 6.0 mp -92.66 110.24 21.66 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.664 -179.19 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 8' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 -132.91 87.52 2.41 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 178.298 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 9' ' ' GLY . . . . . 0.837 ' C ' ' HZ1' ' X' ' 13' ' ' LYS . . . -122.79 -147.35 7.39 Favored Glycine 0 N--CA 1.464 0.537 0 N-CA-C 111.462 -0.655 . . . . 0.0 111.462 -179.203 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 10' ' ' LYS . . . . . . . . . . . . . 57.1 mttt -79.17 -50.15 11.43 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 120.989 -0.284 . . . . 0.0 111.46 -179.486 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 11' ' ' THR . . . . . 0.436 ' C ' ' HZ3' ' X' ' 13' ' ' LYS . 41.5 p -130.35 -19.62 3.09 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 -179.427 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 12' ' ' LEU . . . . . 0.749 ' N ' ' HZ3' ' X' ' 13' ' ' LYS . 0.5 OUTLIER -92.15 119.51 31.87 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-O 120.648 0.261 . . . . 0.0 111.156 -178.943 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' X' X ' 13' ' ' LYS . . . . . 0.837 ' HZ1' ' C ' ' X' ' 9' ' ' GLY . 0.1 OUTLIER -140.18 139.24 35.66 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 120.907 0.384 . . . . 0.0 110.255 179.449 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' X' X ' 14' ' ' GLY . . . . . 0.438 ' O ' ' OE1' ' X' ' 15' ' ' GLU . . . 173.79 -155.01 21.13 Favored Glycine 0 CA--C 1.533 1.216 0 N-CA-C 110.671 -0.972 . . . . 0.0 110.671 -179.933 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 15' ' ' GLU . . . . . 0.438 ' OE1' ' O ' ' X' ' 14' ' ' GLY . 5.0 mm-40 -133.82 151.09 51.46 Favored 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 110.098 -0.334 . . . . 0.0 110.098 179.622 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 2.8 m -147.86 129.18 14.78 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.052 178.924 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 17' ' ' THR . . . . . 0.533 HG23 ' O ' ' X' ' 3' ' ' TYR . 2.4 m -129.47 157.05 43.08 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-O 121.003 0.43 . . . . 0.0 110.551 179.936 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 18' ' ' THR . . . . . . . . . . . . . 7.2 t -150.55 152.69 34.52 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.601 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 19' ' ' GLU . . . . . 0.443 ' OE2' ' O ' ' X' ' 1' ' ' MET . 1.2 tm-20 -104.42 105.61 15.8 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.846 -0.427 . . . . 0.0 109.846 -179.626 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 20' ' ' ALA . . . . . . . . . . . . . . . -136.39 163.29 30.79 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.728 -179.668 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 21' ' ' VAL . . . . . 0.447 ' H ' HG12 ' X' ' 21' ' ' VAL . 1.1 p -89.04 -41.23 13.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.358 179.356 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 22' ' ' ASP . . . . . . . . . . . . . 46.5 t0 -102.27 152.71 20.74 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.335 -179.267 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 23' ' ' ALA . . . . . . . . . . . . . . . -75.14 -39.68 60.28 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.73 179.645 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 24' ' ' ALA . . . . . . . . . . . . . . . -67.51 -39.84 85.12 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.332 -179.087 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 25' ' ' THR . . . . . . . . . . . . . 1.2 t -64.24 -33.33 75.57 Favored 'General case' 0 C--N 1.345 0.409 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.62 -179.73 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.12 -35.99 79.01 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.973 0.416 . . . . 0.0 110.681 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 27' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -62.88 -28.43 70.03 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.594 -179.607 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 28' ' ' LYS . . . . . . . . . . . . . 83.5 mttt -57.17 -43.77 82.9 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 120.588 -0.445 . . . . 0.0 109.805 -179.163 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 29' ' ' VAL . . . . . 0.451 ' O ' ' N ' ' X' ' 33' ' ' TYR . 11.9 t -70.24 -50.88 43.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.588 179.296 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 30' ' ' PHE . . . . . . . . . . . . . 56.0 m-85 -61.76 -43.93 97.88 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.181 -0.463 . . . . 0.0 112.011 -179.236 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 31' ' ' LYS . . . . . . . . . . . . . 69.7 mttt -69.26 -41.76 76.48 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 120.173 -0.611 . . . . 0.0 110.281 -179.794 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 32' ' ' GLN . . . . . . . . . . . . . 59.6 tp60 -73.2 -33.14 65.22 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.038 0.447 . . . . 0.0 110.039 179.226 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 33' ' ' TYR . . . . . 0.451 ' N ' ' O ' ' X' ' 29' ' ' VAL . 69.3 t80 -71.23 -42.18 69.2 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.12 -179.794 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 34' ' ' ALA . . . . . 0.408 ' HB1' ' O ' ' X' ' 39' ' ' VAL . . . -58.73 -38.08 77.58 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 120.839 -0.344 . . . . 0.0 110.4 -179.09 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 35' ' ' ASN . . . . . . . . . . . . . 40.3 t-20 -63.19 -45.54 91.27 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 179.042 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 36' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -66.81 -25.02 66.25 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.622 179.415 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 37' ' ' ASN . . . . . 0.407 ' O ' HD12 ' X' ' 12' ' ' LEU . 0.1 OUTLIER -85.09 -26.53 26.89 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.983 -178.839 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' X' X ' 38' ' ' GLY . . . . . . . . . . . . . . . 113.19 -37.91 3.43 Favored Glycine 0 CA--C 1.531 1.052 0 C-N-CA 121.541 -0.362 . . . . 0.0 112.973 178.354 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 39' ' ' VAL . . . . . 0.408 ' O ' ' HB1' ' X' ' 34' ' ' ALA . 1.5 p -80.63 108.64 14.22 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.394 0 CA-C-N 117.73 0.765 . . . . 0.0 111.161 -178.551 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 40' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -127.42 110.85 13.2 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.677 179.172 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 41' ' ' GLY . . . . . 0.502 ' H ' ' CG2' ' X' ' 54' ' ' VAL . . . -142.26 -155.17 6.35 Favored Glycine 0 CA--C 1.532 1.11 0 C-N-CA 120.606 -0.807 . . . . 0.0 111.981 -179.407 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 42' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -75.12 132.06 40.95 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-O 120.885 0.374 . . . . 0.0 110.152 -179.699 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 43' ' ' TRP . . . . . . . . . . . . . 81.5 m95 -97.92 161.41 13.75 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.65 0.738 . . . . 0.0 112.05 -178.672 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 44' ' ' THR . . . . . 0.502 ' CG2' ' OG1' ' X' ' 53' ' ' THR . 2.5 t -157.0 169.07 25.66 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 114.509 -1.223 . . . . 0.0 108.885 179.483 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 45' ' ' TYR . . . . . 0.615 ' CD1' ' CE1' ' X' ' 52' ' ' PHE . 2.6 t80 -173.9 135.55 0.5 Allowed 'General case' 0 C--N 1.331 -0.21 0 C-N-CA 119.697 -0.801 . . . . 0.0 111.691 -179.917 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 46' ' ' ASP . . . . . 0.539 ' N ' ' CD1' ' X' ' 45' ' ' TYR . 8.1 t0 -123.84 112.6 17.47 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 115.155 -0.929 . . . . 0.0 108.872 178.067 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 47' ' ' ASP . . . . . 0.422 ' OD1' ' OH ' ' X' ' 45' ' ' TYR . 25.0 t0 -66.47 -15.48 63.38 Favored 'General case' 0 C--O 1.23 0.057 0 CA-C-O 120.728 0.299 . . . . 0.0 110.856 -179.722 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.51 -14.88 58.57 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.069 -179.702 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 49' ' ' THR . . . . . . . . . . . . . 2.7 p -128.28 3.84 5.75 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 121.394 -0.122 . . . . 0.0 110.792 -179.656 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 50' ' ' LYS . . . . . 0.55 ' NZ ' ' SD ' ' X' ' 1' ' ' MET . 64.3 mmtt 40.89 57.34 2.74 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 120.922 -0.311 . . . . 0.0 110.693 -179.885 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 51' ' ' THR . . . . . . . . . . . . . 85.1 m -146.62 127.88 14.81 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 120.725 0.298 . . . . 0.0 111.747 -179.435 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 52' ' ' PHE . . . . . 0.615 ' CE1' ' CD1' ' X' ' 45' ' ' TYR . 10.5 m-85 -107.64 154.11 21.92 Favored 'General case' 0 C--N 1.342 0.261 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 178.749 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 53' ' ' THR . . . . . 0.502 ' OG1' ' CG2' ' X' ' 44' ' ' THR . 36.4 p -150.97 130.36 12.88 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 120.447 -0.501 . . . . 0.0 110.187 179.07 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 54' ' ' VAL . . . . . 0.502 ' CG2' ' H ' ' X' ' 41' ' ' GLY . 14.4 p -113.51 123.92 69.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 179.192 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 55' ' ' THR . . . . . 0.507 HG23 ' O ' ' X' ' 55' ' ' THR . 4.3 t -125.24 121.38 33.91 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.525 -178.599 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 56' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 . . . . . 0 C--O 1.219 -0.533 0 CA-C-O 118.067 -0.968 . . . . 0.0 110.035 179.499 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' X' X ' 1' ' ' MET . . . . . 0.53 ' SD ' ' NZ ' ' X' ' 50' ' ' LYS . 0.4 OUTLIER . . . . . 0 N--CA 1.494 1.771 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 2' ' ' GLN . . . . . . . . . . . . . 83.6 mt-30 -127.14 137.54 52.99 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.004 0.43 . . . . 0.0 111.51 -179.135 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 3' ' ' TYR . . . . . 0.515 ' O ' HG23 ' X' ' 17' ' ' THR . 62.6 m-85 -116.93 139.63 50.42 Favored 'General case' 0 CA--C 1.517 -0.303 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 178.729 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 4' ' ' LYS . . . . . . . . . . . . . 52.3 tttp -120.93 127.83 52.19 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-O 120.911 0.386 . . . . 0.0 110.925 -179.3 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 5' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -105.01 129.0 53.56 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 179.08 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 6' ' ' ILE . . . . . . . . . . . . . 32.1 mm -100.94 129.79 51.31 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.419 0 N-CA-C 109.63 -0.508 . . . . 0.0 109.63 178.696 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 7' ' ' LEU . . . . . 0.407 ' HB2' ' H ' ' X' ' 14' ' ' GLY . 5.1 mp -93.43 110.04 21.61 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.771 -179.587 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 8' ' ' ASN . . . . . 0.523 ' OD1' ' N ' ' X' ' 8' ' ' ASN . 5.1 p-10 -134.83 87.36 2.33 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 178.039 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 9' ' ' GLY . . . . . 0.86 ' C ' ' HZ1' ' X' ' 13' ' ' LYS . . . -122.24 -145.84 7.13 Favored Glycine 0 N--CA 1.464 0.546 0 N-CA-C 111.527 -0.629 . . . . 0.0 111.527 -179.302 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 10' ' ' LYS . . . . . . . . . . . . . 41.2 mtmt -80.61 -49.49 11.21 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 121.157 -0.217 . . . . 0.0 111.551 -179.381 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 11' ' ' THR . . . . . 0.426 ' C ' ' HZ3' ' X' ' 13' ' ' LYS . 41.6 p -129.97 -19.45 3.24 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -179.34 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 12' ' ' LEU . . . . . 0.766 ' N ' ' HZ3' ' X' ' 13' ' ' LYS . 0.4 OUTLIER -93.12 119.18 32.05 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 120.624 0.249 . . . . 0.0 111.066 -178.954 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' X' X ' 13' ' ' LYS . . . . . 0.86 ' HZ1' ' C ' ' X' ' 9' ' ' GLY . 0.1 OUTLIER -141.52 139.21 33.19 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-O 120.974 0.416 . . . . 0.0 110.351 179.351 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' X' X ' 14' ' ' GLY . . . . . 0.438 ' O ' ' OE1' ' X' ' 15' ' ' GLU . . . 173.62 -155.11 21.52 Favored Glycine 0 CA--C 1.533 1.195 0 N-CA-C 110.771 -0.932 . . . . 0.0 110.771 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 15' ' ' GLU . . . . . 0.438 ' OE1' ' O ' ' X' ' 14' ' ' GLY . 6.6 mm-40 -129.72 154.64 46.97 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.85 0.357 . . . . 0.0 110.218 179.553 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -147.54 145.47 29.09 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.067 179.797 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 17' ' ' THR . . . . . 0.515 HG23 ' O ' ' X' ' 3' ' ' TYR . 1.8 m -146.11 157.25 43.84 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.943 0.401 . . . . 0.0 111.048 179.23 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 18' ' ' THR . . . . . . . . . . . . . 7.4 t -155.24 152.9 29.86 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.102 179.636 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 19' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -104.42 105.91 16.21 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 179.805 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 20' ' ' ALA . . . . . . . . . . . . . . . -130.64 159.01 38.48 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 121.107 0.48 . . . . 0.0 110.793 -179.849 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 21' ' ' VAL . . . . . 0.441 ' H ' HG12 ' X' ' 21' ' ' VAL . 1.0 OUTLIER -82.14 -41.09 17.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.316 179.118 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' X' X ' 22' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -111.56 157.3 20.53 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.131 -179.45 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.88 -42.92 56.93 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.659 -0.701 . . . . 0.0 111.133 179.849 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 24' ' ' ALA . . . . . . . . . . . . . . . -66.34 -41.38 89.66 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.563 -178.927 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 25' ' ' THR . . . . . . . . . . . . . 1.2 t -59.63 -35.61 74.72 Favored 'General case' 0 C--N 1.345 0.406 0 C-N-CA 120.734 -0.386 . . . . 0.0 110.716 -179.619 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.85 -35.02 77.84 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.924 0.392 . . . . 0.0 110.655 -179.925 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 27' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -57.25 -29.32 63.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.806 -179.317 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 28' ' ' LYS . . . . . . . . . . . . . 41.8 mtmt -57.34 -43.85 83.77 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.234 -178.819 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 29' ' ' VAL . . . . . 0.444 ' O ' ' CB ' ' X' ' 33' ' ' TYR . 19.1 t -69.47 -46.35 76.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.174 179.168 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 30' ' ' PHE . . . . . . . . . . . . . 8.4 m-30 -61.52 -43.41 98.91 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.308 -179.621 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 31' ' ' LYS . . . . . . . . . . . . . 2.4 tppt? -63.14 -50.1 71.76 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 120.335 -0.546 . . . . 0.0 110.763 -179.459 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 32' ' ' GLN . . . . . . . . . . . . . 93.7 mm-40 -73.52 -34.44 65.24 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.317 -179.659 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 33' ' ' TYR . . . . . 0.676 ' CZ ' ' ND2' ' X' ' 37' ' ' ASN . 69.0 t80 -61.74 -43.48 98.78 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.88 -179.535 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 34' ' ' ALA . . . . . 0.553 ' HB1' ' O ' ' X' ' 39' ' ' VAL . . . -59.11 -37.63 77.65 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.421 -179.082 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 35' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -64.18 -47.22 80.65 Favored 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 179.221 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 36' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -66.87 -26.08 66.72 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.645 179.602 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 37' ' ' ASN . . . . . 0.676 ' ND2' ' CZ ' ' X' ' 33' ' ' TYR . 0.8 OUTLIER -84.0 -26.66 28.99 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.807 -179.283 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' X' X ' 38' ' ' GLY . . . . . . . . . . . . . . . 112.15 -39.25 2.93 Favored Glycine 0 CA--C 1.531 1.076 0 C-N-CA 121.555 -0.355 . . . . 0.0 112.364 178.622 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 39' ' ' VAL . . . . . 0.553 ' O ' ' HB1' ' X' ' 34' ' ' ALA . 1.6 p -80.78 108.75 14.46 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 CA-C-N 117.4 0.6 . . . . 0.0 111.211 -178.774 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 40' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -127.71 112.31 14.67 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.737 179.306 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 41' ' ' GLY . . . . . 0.469 ' H ' ' CG2' ' X' ' 54' ' ' VAL . . . -142.92 -153.73 5.96 Favored Glycine 0 CA--C 1.533 1.197 0 C-N-CA 120.337 -0.935 . . . . 0.0 112.283 -179.431 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 42' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -74.53 139.13 43.58 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 -179.899 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 43' ' ' TRP . . . . . . . . . . . . . 90.8 m95 -102.83 162.36 12.99 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.817 0.817 . . . . 0.0 112.686 -178.052 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 44' ' ' THR . . . . . 0.5 ' CG2' ' OG1' ' X' ' 53' ' ' THR . 2.8 t -156.9 167.85 29.23 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.35 -1.295 . . . . 0.0 108.821 179.206 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 45' ' ' TYR . . . . . 0.629 ' CD1' ' CE1' ' X' ' 52' ' ' PHE . 19.1 t80 -172.88 134.45 0.59 Allowed 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 119.748 -0.781 . . . . 0.0 111.771 179.992 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 46' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -123.66 112.33 17.27 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 115.25 -0.886 . . . . 0.0 108.708 177.87 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 47' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -68.61 -16.33 63.81 Favored 'General case' 0 C--O 1.231 0.121 0 CA-C-O 120.815 0.341 . . . . 0.0 110.988 -179.552 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.16 -13.56 59.64 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.101 -179.824 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 49' ' ' THR . . . . . . . . . . . . . 2.5 p -128.22 3.0 5.77 Favored 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 110.508 -0.182 . . . . 0.0 110.508 -179.793 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 50' ' ' LYS . . . . . 0.53 ' NZ ' ' SD ' ' X' ' 1' ' ' MET . 64.5 mmtt 41.54 57.48 2.99 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 120.908 -0.317 . . . . 0.0 110.544 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 51' ' ' THR . . . . . . . . . . . . . 96.9 m -147.01 128.67 15.17 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 111.891 0.33 . . . . 0.0 111.891 -179.346 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 52' ' ' PHE . . . . . 0.629 ' CE1' ' CD1' ' X' ' 45' ' ' TYR . 27.9 m-85 -107.84 156.23 19.39 Favored 'General case' 0 C--N 1.345 0.376 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 178.717 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 53' ' ' THR . . . . . 0.5 ' OG1' ' CG2' ' X' ' 44' ' ' THR . 11.6 p -152.14 128.83 10.82 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 178.767 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 54' ' ' VAL . . . . . 0.469 ' CG2' ' H ' ' X' ' 41' ' ' GLY . 10.4 p -112.74 123.98 68.95 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 178.776 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 55' ' ' THR . . . . . 0.471 HG23 ' O ' ' X' ' 55' ' ' THR . 3.0 t -124.93 123.27 39.54 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 116.561 -0.291 . . . . 0.0 111.708 -178.053 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 56' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 . . . . . 0 C--O 1.22 -0.494 0 CA-C-O 118.015 -0.993 . . . . 0.0 110.062 179.36 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' X' X ' 1' ' ' MET . . . . . 0.588 ' SD ' ' CZ ' ' X' ' 3' ' ' TYR . 0.1 OUTLIER . . . . . 0 N--CA 1.493 1.683 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 2' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -126.28 146.23 50.1 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.908 0.385 . . . . 0.0 110.622 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 3' ' ' TYR . . . . . 0.588 ' CZ ' ' SD ' ' X' ' 1' ' ' MET . 73.5 m-85 -115.3 142.66 46.38 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.463 179.462 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 4' ' ' LYS . . . . . . . . . . . . . 10.1 ttmm -119.45 127.2 52.86 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 121.024 0.44 . . . . 0.0 110.187 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 5' ' ' LEU . . . . . 0.708 ' C ' HD13 ' X' ' 5' ' ' LEU . 1.0 OUTLIER -107.8 127.64 53.89 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 179.664 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' X' X ' 6' ' ' ILE . . . . . 0.537 ' N ' HD22 ' X' ' 5' ' ' LEU . 29.2 mm -98.4 132.24 43.9 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.467 0 CA-C-O 120.907 0.384 . . . . 0.0 110.073 -179.474 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 7' ' ' LEU . . . . . 0.418 HD23 HD22 ' X' ' 12' ' ' LEU . 6.2 mp -91.91 113.62 25.94 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.283 -179.156 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 8' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -131.78 87.73 2.48 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 178.165 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 9' ' ' GLY . . . . . 0.62 ' H ' ' NZ ' ' X' ' 13' ' ' LYS . . . -124.62 -163.24 11.62 Favored Glycine 0 N--CA 1.463 0.48 0 N-CA-C 111.542 -0.623 . . . . 0.0 111.542 -178.68 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 10' ' ' LYS . . . . . . . . . . . . . 55.5 mttt -75.94 -48.86 19.56 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 120.86 -0.336 . . . . 0.0 110.982 -179.692 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 11' ' ' THR . . . . . . . . . . . . . 41.3 p -130.73 19.3 5.12 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 112.177 0.436 . . . . 0.0 112.177 -179.301 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 12' ' ' LEU . . . . . 0.765 ' H ' ' HZ1' ' X' ' 13' ' ' LYS . 0.5 OUTLIER -138.4 108.12 6.26 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 120.848 0.356 . . . . 0.0 111.337 -179.435 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' X' X ' 13' ' ' LYS . . . . . 0.765 ' HZ1' ' H ' ' X' ' 12' ' ' LEU . 0.2 OUTLIER -131.78 139.94 49.06 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.264 179.429 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' X' X ' 14' ' ' GLY . . . . . 0.412 ' H ' ' HB2' ' X' ' 7' ' ' LEU . . . 174.6 -155.19 20.59 Favored Glycine 0 CA--C 1.535 1.323 0 N-CA-C 110.839 -0.905 . . . . 0.0 110.839 -179.794 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 15' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -134.4 149.94 50.84 Favored 'General case' 0 N--CA 1.468 0.449 0 O-C-N 122.717 -0.284 . . . . 0.0 110.517 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 2.7 m -148.28 129.5 14.64 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 120.88 -0.328 . . . . 0.0 110.343 178.859 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 17' ' ' THR . . . . . 0.561 HG23 ' O ' ' X' ' 3' ' ' TYR . 2.6 m -131.66 157.24 44.23 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 120.92 0.39 . . . . 0.0 110.451 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 18' ' ' THR . . . . . . . . . . . . . 7.1 t -152.67 152.81 32.17 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.087 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 19' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -104.2 105.86 16.16 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.785 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 20' ' ' ALA . . . . . . . . . . . . . . . -130.01 162.64 28.24 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.998 -179.336 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 21' ' ' VAL . . . . . 0.442 HG12 ' H ' ' X' ' 21' ' ' VAL . 1.2 p -82.98 -37.58 13.95 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.268 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.716 179.515 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 22' ' ' ASP . . . . . 0.509 ' OD1' ' N ' ' X' ' 23' ' ' ALA . 33.0 t0 -115.47 156.25 25.99 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.943 -179.532 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 23' ' ' ALA . . . . . 0.509 ' N ' ' OD1' ' X' ' 22' ' ' ASP . . . -74.94 -42.78 57.01 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.026 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 24' ' ' ALA . . . . . . . . . . . . . . . -65.71 -39.26 91.01 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.669 -179.054 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 25' ' ' THR . . . . . . . . . . . . . 1.2 t -63.21 -34.57 77.93 Favored 'General case' 0 C--N 1.346 0.437 0 C-N-CA 120.669 -0.413 . . . . 0.0 110.7 -179.561 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.0 -35.82 78.96 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.904 0.383 . . . . 0.0 110.73 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 27' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -58.27 -29.08 65.53 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.665 -179.779 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 28' ' ' LYS . . . . . 0.416 ' O ' ' OE1' ' X' ' 32' ' ' GLN . 41.4 mtmt -57.22 -43.49 82.86 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 120.456 -0.498 . . . . 0.0 110.031 -179.079 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 29' ' ' VAL . . . . . 0.43 ' O ' ' CB ' ' X' ' 33' ' ' TYR . 12.1 t -69.95 -50.76 45.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.459 179.394 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 30' ' ' PHE . . . . . . . . . . . . . 57.9 m-85 -61.54 -43.15 99.39 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.878 -179.319 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 31' ' ' LYS . . . . . . . . . . . . . 68.1 mttt -70.52 -41.78 72.14 Favored 'General case' 0 C--O 1.232 0.155 0 C-N-CA 120.23 -0.588 . . . . 0.0 110.55 -179.499 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 32' ' ' GLN . . . . . 0.416 ' OE1' ' O ' ' X' ' 28' ' ' LYS . 79.2 mt-30 -73.14 -33.52 65.55 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.02 0.438 . . . . 0.0 109.853 179.218 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 33' ' ' TYR . . . . . 0.43 ' CB ' ' O ' ' X' ' 29' ' ' VAL . 27.2 t80 -64.98 -37.62 88.24 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.518 179.844 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 34' ' ' ALA . . . . . 0.52 ' HB1' ' O ' ' X' ' 39' ' ' VAL . . . -59.68 -40.18 86.98 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.611 -179.456 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 35' ' ' ASN . . . . . . . . . . . . . 9.6 m-80 -68.24 -38.44 81.85 Favored 'General case' 0 N--CA 1.456 -0.151 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 179.326 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 36' ' ' ASP . . . . . 0.477 ' N ' ' OD1' ' X' ' 36' ' ' ASP . 0.9 OUTLIER -67.51 -32.15 72.76 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 115.492 -0.776 . . . . 0.0 112.055 -179.866 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' X' X ' 37' ' ' ASN . . . . . 0.623 HD21 ' CG1' ' X' ' 39' ' ' VAL . 17.8 p-10 -91.78 -24.73 19.32 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 -178.431 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 38' ' ' GLY . . . . . 0.543 ' N ' ' OD1' ' X' ' 37' ' ' ASN . . . 118.55 -37.98 3.04 Favored Glycine 0 CA--C 1.534 1.278 0 C-N-CA 121.236 -0.507 . . . . 0.0 113.886 177.726 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 39' ' ' VAL . . . . . 0.623 ' CG1' HD21 ' X' ' 37' ' ' ASN . 1.5 p -80.16 108.39 13.56 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 CA-C-N 118.009 0.905 . . . . 0.0 111.442 -178.064 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 40' ' ' ASP . . . . . . . . . . . . . 22.0 t0 -127.79 111.76 14.01 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.907 179.267 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 41' ' ' GLY . . . . . 0.514 ' H ' ' CG2' ' X' ' 54' ' ' VAL . . . -141.23 -155.37 6.46 Favored Glycine 0 CA--C 1.534 1.27 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.038 -179.589 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 42' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -75.0 136.76 41.25 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-O 120.702 0.287 . . . . 0.0 110.266 -179.682 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 43' ' ' TRP . . . . . . . . . . . . . 82.4 m95 -103.23 162.01 13.33 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.898 0.856 . . . . 0.0 112.535 -178.3 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 44' ' ' THR . . . . . 0.475 ' CG2' ' OG1' ' X' ' 53' ' ' THR . 9.0 t -157.06 166.99 31.76 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 114.071 -1.422 . . . . 0.0 108.384 179.103 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 45' ' ' TYR . . . . . 0.629 ' CE1' ' CE1' ' X' ' 52' ' ' PHE . 16.8 t80 -172.46 133.78 0.65 Allowed 'General case' 0 C--N 1.332 -0.195 0 C-N-CA 119.607 -0.837 . . . . 0.0 112.079 179.943 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 46' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -123.9 112.47 17.29 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 115.125 -0.943 . . . . 0.0 108.482 177.673 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 47' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -67.69 -16.29 64.07 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-O 120.672 0.272 . . . . 0.0 111.068 -179.388 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.35 -14.81 58.73 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.141 -179.77 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 49' ' ' THR . . . . . . . . . . . . . 2.8 p -125.73 2.8 7.48 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 110.44 -0.208 . . . . 0.0 110.44 -179.866 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 50' ' ' LYS . . . . . . . . . . . . . 67.0 mmtt 41.61 58.46 2.74 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 120.884 -0.326 . . . . 0.0 110.551 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 51' ' ' THR . . . . . . . . . . . . . 97.4 m -147.71 126.69 12.8 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 112.132 0.419 . . . . 0.0 112.132 -179.34 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 52' ' ' PHE . . . . . 0.629 ' CE1' ' CE1' ' X' ' 45' ' ' TYR . 26.8 m-85 -107.92 155.55 20.18 Favored 'General case' 0 C--N 1.344 0.352 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 178.436 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 53' ' ' THR . . . . . 0.475 ' OG1' ' CG2' ' X' ' 44' ' ' THR . 47.0 p -151.98 129.49 11.43 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 120.401 -0.52 . . . . 0.0 110.492 179.202 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 54' ' ' VAL . . . . . 0.514 ' CG2' ' H ' ' X' ' 41' ' ' GLY . 10.7 p -113.69 123.62 69.53 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.497 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 178.964 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 55' ' ' THR . . . . . 0.542 HG23 ' O ' ' X' ' 55' ' ' THR . 4.9 t -125.46 119.89 29.46 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.299 -178.716 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 56' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 . . . . . 0 C--O 1.219 -0.507 0 CA-C-O 118.009 -0.996 . . . . 0.0 110.088 179.635 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' X' X ' 1' ' ' MET . . . . . 0.526 ' SD ' ' NZ ' ' X' ' 50' ' ' LYS . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.665 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 . . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 2' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -127.19 145.18 50.85 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 120.908 0.385 . . . . 0.0 110.972 -179.623 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 3' ' ' TYR . . . . . 0.524 ' O ' HG23 ' X' ' 17' ' ' THR . 61.3 m-85 -122.36 137.68 54.77 Favored 'General case' 0 CA--C 1.518 -0.259 0 CA-C-N 115.835 -0.621 . . . . 0.0 109.495 179.213 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 4' ' ' LYS . . . . . . . . . . . . . 45.3 tttp -119.58 127.62 53.14 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 120.978 0.418 . . . . 0.0 110.721 -179.639 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 5' ' ' LEU . . . . . 0.695 ' C ' HD13 ' X' ' 5' ' ' LEU . 1.0 OUTLIER -108.76 127.77 54.3 Favored 'General case' 0 N--CA 1.464 0.271 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 179.077 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' X' X ' 6' ' ' ILE . . . . . 0.531 ' N ' HD22 ' X' ' 5' ' ' LEU . 29.1 mm -98.12 132.57 42.81 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.46 0 CA-C-O 121.137 0.494 . . . . 0.0 110.006 -179.207 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 7' ' ' LEU . . . . . 0.475 HD23 HD22 ' X' ' 12' ' ' LEU . 6.0 mp -91.65 115.26 27.9 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.443 -178.922 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 8' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -134.28 86.95 2.31 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 108.045 -1.095 . . . . 0.0 108.045 177.578 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 9' ' ' GLY . . . . . 0.516 ' H ' ' HD3' ' X' ' 13' ' ' LYS . . . -125.97 -163.36 11.53 Favored Glycine 0 C--N 1.335 0.479 0 N-CA-C 111.506 -0.638 . . . . 0.0 111.506 -178.871 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 10' ' ' LYS . . . . . . . . . . . . . 57.8 mttt -76.97 -46.98 22.15 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.973 -0.291 . . . . 0.0 111.155 -179.655 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 11' ' ' THR . . . . . . . . . . . . . 42.1 p -130.57 18.33 5.26 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 -179.26 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 12' ' ' LEU . . . . . 0.657 ' N ' ' HZ2' ' X' ' 13' ' ' LYS . 0.3 OUTLIER -138.59 100.4 4.07 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 120.87 -0.332 . . . . 0.0 111.52 -179.632 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' X' X ' 13' ' ' LYS . . . . . 0.657 ' HZ2' ' N ' ' X' ' 12' ' ' LEU . 0.0 OUTLIER -122.21 137.56 54.79 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 178.895 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' X' X ' 14' ' ' GLY . . . . . 0.435 ' O ' ' OE1' ' X' ' 15' ' ' GLU . . . 173.44 -155.16 21.8 Favored Glycine 0 CA--C 1.534 1.271 0 N-CA-C 110.923 -0.871 . . . . 0.0 110.923 -179.902 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 15' ' ' GLU . . . . . 0.435 ' OE1' ' O ' ' X' ' 14' ' ' GLY . 5.1 mm-40 -134.73 150.64 50.6 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 110.061 -0.348 . . . . 0.0 110.061 179.615 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 1.9 m -148.08 129.67 14.99 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.301 178.926 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 17' ' ' THR . . . . . 0.524 HG23 ' O ' ' X' ' 3' ' ' TYR . 2.3 m -129.41 157.21 42.6 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 120.98 0.419 . . . . 0.0 110.608 179.858 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 18' ' ' THR . . . . . . . . . . . . . 7.4 t -149.26 153.31 37.38 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.85 -179.854 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 19' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -103.81 105.67 15.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.218 -0.446 . . . . 0.0 109.847 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 20' ' ' ALA . . . . . . . . . . . . . . . -136.28 161.97 34.3 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.635 -179.695 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 21' ' ' VAL . . . . . 0.422 ' H ' HG12 ' X' ' 21' ' ' VAL . 1.1 p -87.3 -40.79 14.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.44 179.345 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 22' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -104.75 155.78 18.58 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.402 -179.163 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 23' ' ' ALA . . . . . . . . . . . . . . . -75.09 -45.94 37.93 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.943 179.772 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 24' ' ' ALA . . . . . . . . . . . . . . . -62.88 -40.22 96.85 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.518 -179.059 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 25' ' ' THR . . . . . . . . . . . . . 1.2 t -63.28 -33.06 74.68 Favored 'General case' 0 C--N 1.346 0.432 0 O-C-N 122.016 -0.428 . . . . 0.0 110.716 -179.706 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.1 -35.84 78.8 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.88 0.371 . . . . 0.0 110.581 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 27' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -62.46 -28.57 69.91 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.509 -179.733 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 28' ' ' LYS . . . . . 0.418 ' O ' ' OE1' ' X' ' 32' ' ' GLN . 84.0 mttt -57.51 -43.88 84.6 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.255 -0.429 . . . . 0.0 109.885 -179.012 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 29' ' ' VAL . . . . . 0.441 ' O ' ' CB ' ' X' ' 33' ' ' TYR . 13.1 t -70.03 -50.27 49.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.498 179.366 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 30' ' ' PHE . . . . . . . . . . . . . 55.9 m-85 -61.67 -43.53 98.67 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.831 -179.363 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 31' ' ' LYS . . . . . . . . . . . . . 72.0 mttt -69.5 -42.14 75.13 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 120.352 -0.539 . . . . 0.0 110.49 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 32' ' ' GLN . . . . . 0.418 ' OE1' ' O ' ' X' ' 28' ' ' LYS . 79.6 mt-30 -73.21 -33.24 65.26 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.044 0.45 . . . . 0.0 109.954 179.371 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 33' ' ' TYR . . . . . 0.67 ' CZ ' ' ND2' ' X' ' 37' ' ' ASN . 65.9 t80 -68.31 -36.97 80.13 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.704 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.23 -38.51 80.15 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.43 -179.23 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 35' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -60.85 -48.09 83.4 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 109.835 -0.432 . . . . 0.0 109.835 179.39 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 36' ' ' ASP . . . . . 0.407 ' OD1' ' N ' ' X' ' 36' ' ' ASP . 1.6 m-20 -66.87 -24.44 66.12 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.977 179.554 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 37' ' ' ASN . . . . . 0.67 ' ND2' ' CZ ' ' X' ' 33' ' ' TYR . 0.4 OUTLIER -86.62 -26.81 24.21 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.082 -178.702 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' X' X ' 38' ' ' GLY . . . . . . . . . . . . . . . 106.48 -34.98 5.34 Favored Glycine 0 CA--C 1.532 1.146 0 C-N-CA 121.343 -0.456 . . . . 0.0 112.915 178.499 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 39' ' ' VAL . . . . . 0.426 HG12 ' H ' ' X' ' 39' ' ' VAL . 2.1 p -80.4 107.88 13.23 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 CA-C-N 117.728 0.764 . . . . 0.0 110.873 -178.831 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 40' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -127.8 110.83 12.99 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 115.789 -0.642 . . . . 0.0 109.964 179.551 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 41' ' ' GLY . . . . . 0.513 ' H ' ' CG2' ' X' ' 54' ' ' VAL . . . -141.28 -155.39 6.46 Favored Glycine 0 CA--C 1.532 1.115 0 C-N-CA 120.763 -0.732 . . . . 0.0 111.769 -179.541 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 42' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -75.08 131.14 40.34 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 120.94 0.4 . . . . 0.0 110.202 -179.792 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 43' ' ' TRP . . . . . . . . . . . . . 83.6 m95 -97.38 161.42 13.8 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.651 0.739 . . . . 0.0 112.101 -178.764 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 44' ' ' THR . . . . . 0.5 ' CG2' ' OG1' ' X' ' 53' ' ' THR . 2.5 t -157.05 167.95 28.91 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.559 -1.2 . . . . 0.0 108.786 179.33 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 45' ' ' TYR . . . . . 0.635 ' CD1' ' CE1' ' X' ' 52' ' ' PHE . 22.1 t80 -170.56 134.23 1.08 Allowed 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 119.7 -0.8 . . . . 0.0 111.856 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 46' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -123.73 112.38 17.28 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 115.145 -0.934 . . . . 0.0 108.646 177.748 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 47' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -68.45 -16.39 63.88 Favored 'General case' 0 C--O 1.231 0.096 0 CA-C-O 120.716 0.294 . . . . 0.0 110.998 -179.419 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.35 -13.55 59.55 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.068 -179.748 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 49' ' ' THR . . . . . . . . . . . . . 2.6 p -128.19 2.95 5.79 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 110.647 -0.131 . . . . 0.0 110.647 -179.768 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 50' ' ' LYS . . . . . 0.526 ' NZ ' ' SD ' ' X' ' 1' ' ' MET . 64.2 mmtt 41.87 57.47 3.14 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 120.754 -0.378 . . . . 0.0 110.442 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 51' ' ' THR . . . . . . . . . . . . . 94.5 m -147.26 128.3 14.58 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 112.06 0.392 . . . . 0.0 112.06 -179.309 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 52' ' ' PHE . . . . . 0.635 ' CE1' ' CD1' ' X' ' 45' ' ' TYR . 29.2 m-85 -107.81 154.82 20.99 Favored 'General case' 0 C--N 1.343 0.325 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 178.561 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 53' ' ' THR . . . . . 0.5 ' OG1' ' CG2' ' X' ' 44' ' ' THR . 34.2 p -151.42 129.1 11.53 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 120.531 -0.467 . . . . 0.0 110.312 179.126 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 54' ' ' VAL . . . . . 0.513 ' CG2' ' H ' ' X' ' 41' ' ' GLY . 12.5 p -113.57 123.81 69.59 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.448 0 N-CA-C 109.381 -0.599 . . . . 0.0 109.381 179.01 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 55' ' ' THR . . . . . 0.554 HG23 ' O ' ' X' ' 55' ' ' THR . 5.3 t -125.45 120.3 30.62 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.399 -178.469 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 56' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 . . . . . 0 C--O 1.22 -0.481 0 CA-C-O 117.971 -1.014 . . . . 0.0 110.137 179.298 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' X' X ' 1' ' ' MET . . . . . 0.582 ' SD ' ' CE2' ' X' ' 3' ' ' TYR . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.705 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 2' ' ' GLN . . . . . . . . . . . . . 98.3 mt-30 -117.88 149.36 41.0 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 121.278 0.561 . . . . 0.0 111.659 -178.563 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 3' ' ' TYR . . . . . 0.582 ' CE2' ' SD ' ' X' ' 1' ' ' MET . 63.2 m-85 -123.39 143.98 49.77 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-N 115.287 -0.87 . . . . 0.0 108.769 178.93 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 4' ' ' LYS . . . . . . . . . . . . . 5.1 tttm -119.43 128.65 54.22 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 121.053 0.454 . . . . 0.0 111.118 -179.117 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 5' ' ' LEU . . . . . 0.709 ' C ' HD13 ' X' ' 5' ' ' LEU . 1.0 OUTLIER -108.93 128.27 54.78 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.283 179.697 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' X' X ' 6' ' ' ILE . . . . . 0.542 ' N ' HD22 ' X' ' 5' ' ' LEU . 26.5 mm -98.88 132.73 43.62 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.439 0 CA-C-O 121.043 0.449 . . . . 0.0 110.144 -179.272 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 7' ' ' LEU . . . . . 0.481 HD21 HD22 ' X' ' 37' ' ' ASN . 6.3 mp -92.09 108.78 20.19 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.36 -179.088 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 8' ' ' ASN . . . . . . . . . . . . . 7.7 t-20 -131.2 87.72 2.51 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 178.621 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 9' ' ' GLY . . . . . 0.812 ' C ' ' HZ1' ' X' ' 13' ' ' LYS . . . -123.04 -147.4 7.36 Favored Glycine 0 N--CA 1.464 0.533 0 N-CA-C 111.505 -0.638 . . . . 0.0 111.505 -179.139 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 10' ' ' LYS . . . . . . . . . . . . . 48.5 mttt -77.78 -51.76 10.0 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 121.054 -0.258 . . . . 0.0 111.435 -179.453 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 11' ' ' THR . . . . . 0.444 ' C ' ' HZ3' ' X' ' 13' ' ' LYS . 41.5 p -130.53 -19.4 3.05 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 112.193 0.442 . . . . 0.0 112.193 -179.408 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 12' ' ' LEU . . . . . 0.779 ' N ' ' HZ3' ' X' ' 13' ' ' LYS . 0.6 OUTLIER -91.37 118.63 30.69 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 120.753 0.311 . . . . 0.0 111.165 -178.803 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' X' X ' 13' ' ' LYS . . . . . 0.812 ' HZ1' ' C ' ' X' ' 9' ' ' GLY . 0.1 OUTLIER -139.26 139.97 37.55 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 120.989 0.423 . . . . 0.0 110.434 179.65 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' X' X ' 14' ' ' GLY . . . . . 0.418 ' H ' ' HB2' ' X' ' 7' ' ' LEU . . . 174.45 -154.72 19.65 Favored Glycine 0 CA--C 1.534 1.27 0 N-CA-C 110.871 -0.891 . . . . 0.0 110.871 -179.777 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 15' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -134.24 151.01 51.07 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 120.677 0.275 . . . . 0.0 110.297 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 2.7 m -147.68 129.43 15.17 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.027 178.838 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 17' ' ' THR . . . . . 0.523 HG23 ' O ' ' X' ' 3' ' ' TYR . 2.0 m -130.77 158.57 39.78 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 120.903 0.382 . . . . 0.0 110.818 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 18' ' ' THR . . . . . . . . . . . . . 6.3 t -154.25 153.29 31.48 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.463 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 19' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -103.85 113.12 26.41 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 179.653 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 20' ' ' ALA . . . . . . . . . . . . . . . -137.34 161.09 37.22 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.018 -179.544 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 21' ' ' VAL . . . . . 0.454 ' H ' HG12 ' X' ' 21' ' ' VAL . 1.1 p -80.83 -39.82 18.3 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.335 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.58 179.331 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 22' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -116.94 156.79 26.81 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.999 -179.432 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.77 -41.31 60.29 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.962 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.18 -36.37 83.86 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.617 -179.126 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 25' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -70.23 -31.77 69.34 Favored 'General case' 0 C--N 1.345 0.384 0 O-C-N 122.091 -0.381 . . . . 0.0 110.795 -179.609 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.03 -35.52 78.4 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.974 0.416 . . . . 0.0 110.703 -179.825 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 27' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -57.61 -29.04 64.19 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.866 -179.565 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 28' ' ' LYS . . . . . . . . . . . . . 41.0 mtmt -56.0 -42.41 76.34 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 120.391 -0.524 . . . . 0.0 110.497 -178.685 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 29' ' ' VAL . . . . . . . . . . . . . 12.1 t -70.12 -51.16 41.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-O 120.889 0.376 . . . . 0.0 110.505 179.283 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 30' ' ' PHE . . . . . . . . . . . . . 60.2 m-85 -61.97 -42.43 99.12 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.971 -179.29 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 31' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -63.06 -51.31 67.17 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 120.738 -0.385 . . . . 0.0 111.075 -179.305 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 32' ' ' GLN . . . . . 0.408 ' O ' ' OD1' ' X' ' 36' ' ' ASP . 79.6 mt-30 -72.09 -32.86 67.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.139 -179.489 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 33' ' ' TYR . . . . . . . . . . . . . 29.1 t80 -60.9 -34.79 75.21 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.873 -179.406 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 34' ' ' ALA . . . . . 0.606 ' HB1' ' O ' ' X' ' 39' ' ' VAL . . . -59.9 -43.55 94.76 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.33 -179.414 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 35' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -66.84 -36.22 81.83 Favored 'General case' 0 N--CA 1.447 -0.621 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 179.4 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 36' ' ' ASP . . . . . 0.494 ' N ' ' OD1' ' X' ' 36' ' ' ASP . 0.7 OUTLIER -67.38 -31.05 71.02 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.893 -179.857 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' X' X ' 37' ' ' ASN . . . . . 0.608 HD21 ' CG1' ' X' ' 39' ' ' VAL . 15.8 p-10 -95.57 -24.58 16.54 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 111.951 0.352 . . . . 0.0 111.951 -178.528 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 38' ' ' GLY . . . . . 0.533 ' N ' ' OD1' ' X' ' 37' ' ' ASN . . . 121.24 -41.06 1.97 Allowed Glycine 0 CA--C 1.532 1.155 0 C-N-CA 121.308 -0.472 . . . . 0.0 113.514 177.957 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 39' ' ' VAL . . . . . 0.608 ' CG1' HD21 ' X' ' 37' ' ' ASN . 1.5 p -80.19 108.57 13.77 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.325 0 CA-C-N 117.735 0.767 . . . . 0.0 111.597 -178.149 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 40' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -127.74 111.54 13.79 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.881 179.084 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 41' ' ' GLY . . . . . 0.513 ' H ' ' CG2' ' X' ' 54' ' ' VAL . . . -141.48 -156.07 6.69 Favored Glycine 0 CA--C 1.534 1.232 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.077 -179.501 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 42' ' ' GLU . . . . . 0.604 ' CD ' ' H ' ' X' ' 42' ' ' GLU . 2.5 mp0 -75.14 139.12 42.5 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-O 120.743 0.306 . . . . 0.0 110.251 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 43' ' ' TRP . . . . . . . . . . . . . 81.3 m95 -103.86 163.47 12.33 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.866 0.841 . . . . 0.0 112.679 -178.262 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 44' ' ' THR . . . . . 0.48 ' CG2' ' OG1' ' X' ' 53' ' ' THR . 10.4 t -156.98 167.07 31.57 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 114.125 -1.398 . . . . 0.0 108.341 178.955 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 45' ' ' TYR . . . . . 0.623 ' CE1' ' CE1' ' X' ' 52' ' ' PHE . 27.5 t80 -171.72 135.44 0.87 Allowed 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 119.603 -0.839 . . . . 0.0 111.858 -179.935 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 46' ' ' ASP . . . . . . . . . . . . . 11.7 t0 -123.29 112.44 17.63 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 177.785 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 47' ' ' ASP . . . . . . . . . . . . . 49.2 t0 -64.6 -15.67 61.5 Favored 'General case' 0 C--N 1.334 -0.076 0 CA-C-N 116.661 -0.245 . . . . 0.0 111.518 -179.143 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.99 -36.15 36.42 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 120.872 -0.331 . . . . 0.0 111.538 -179.494 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 49' ' ' THR . . . . . . . . . . . . . 2.8 p -102.84 2.91 36.04 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 110.632 -0.136 . . . . 0.0 110.632 -179.534 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 50' ' ' LYS . . . . . . . . . . . . . 14.0 mmmt 41.89 56.53 3.43 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 120.68 0.276 . . . . 0.0 110.412 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 51' ' ' THR . . . . . . . . . . . . . 39.0 m -144.32 129.49 18.67 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 -179.241 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 52' ' ' PHE . . . . . 0.623 ' CE1' ' CE1' ' X' ' 45' ' ' TYR . 53.1 m-85 -108.31 153.77 22.76 Favored 'General case' 0 C--N 1.344 0.342 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 178.524 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 53' ' ' THR . . . . . 0.48 ' OG1' ' CG2' ' X' ' 44' ' ' THR . 65.9 p -151.23 130.12 12.47 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 120.522 -0.471 . . . . 0.0 110.476 179.185 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 54' ' ' VAL . . . . . 0.513 ' CG2' ' H ' ' X' ' 41' ' ' GLY . 11.2 p -113.53 123.98 69.72 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 179.21 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 55' ' ' THR . . . . . 0.516 HG23 ' O ' ' X' ' 55' ' ' THR . 4.2 t -125.34 120.68 31.81 Favored 'General case' 0 N--CA 1.474 0.725 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.351 -178.719 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 56' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 . . . . . 0 C--O 1.22 -0.463 0 CA-C-O 117.983 -1.008 . . . . 0.0 110.027 179.607 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' X' X ' 2' ' ' GLN . . . . . . . . . . . . . 29.7 mt-30 . . . . . 0 N--CA 1.466 0.368 0 CA-C-O 121.162 0.506 . . . . 0.0 111.072 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' X' X ' 3' ' ' TYR . . . . . 0.558 ' O ' HG23 ' X' ' 17' ' ' THR . 72.8 m-85 -115.66 143.1 45.84 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.447 179.341 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 4' ' ' LYS . . . . . . . . . . . . . 45.7 tttp -119.6 127.14 52.67 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 120.964 0.412 . . . . 0.0 110.331 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' X' X ' 5' ' ' LEU . . . . . 0.698 HD13 ' C ' ' X' ' 5' ' ' LEU . 1.0 OUTLIER -107.59 127.11 53.35 Favored 'General case' 0 N--CA 1.465 0.276 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 179.471 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' X' X ' 6' ' ' ILE . . . . . 0.535 ' N ' HD22 ' X' ' 5' ' ' LEU . 27.2 mm -98.43 132.91 42.59 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.493 0 CA-C-O 121.231 0.539 . . . . 0.0 109.78 -179.365 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 7' ' ' LEU . . . . . 0.453 HD23 HD22 ' X' ' 12' ' ' LEU . 6.0 mp -91.83 107.72 19.41 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.848 -178.617 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 8' ' ' ASN . . . . . 0.492 ' ND2' ' O ' ' X' ' 54' ' ' VAL . 1.7 p-10 -125.76 85.85 2.45 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 107.045 -1.465 . . . . 0.0 107.045 176.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 9' ' ' GLY . . . . . 0.69 ' C ' ' HZ1' ' X' ' 13' ' ' LYS . . . -116.06 -162.67 13.26 Favored Glycine 0 C--N 1.334 0.439 0 N-CA-C 111.271 -0.732 . . . . 0.0 111.271 -178.785 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 10' ' ' LYS . . . . . . . . . . . . . 48.1 mttt -66.67 -54.5 22.47 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 120.523 -0.471 . . . . 0.0 110.753 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' X' X ' 11' ' ' THR . . . . . . . . . . . . . 42.6 p -130.88 -8.78 3.94 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 120.692 0.282 . . . . 0.0 111.208 179.843 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' X' X ' 12' ' ' LEU . . . . . 0.496 ' O ' ' NZ ' ' X' ' 13' ' ' LYS . 0.6 OUTLIER -95.93 114.69 26.44 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.107 -178.713 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' X' X ' 13' ' ' LYS . . . . . 0.69 ' HZ1' ' C ' ' X' ' 9' ' ' GLY . 0.3 OUTLIER -135.54 142.56 45.4 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-O 120.942 0.401 . . . . 0.0 110.723 179.66 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' X' X ' 14' ' ' GLY . . . . . 0.432 ' O ' ' OE1' ' X' ' 15' ' ' GLU . . . 174.27 -158.03 26.22 Favored Glycine 0 CA--C 1.533 1.205 0 N-CA-C 110.937 -0.865 . . . . 0.0 110.937 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 15' ' ' GLU . . . . . 0.432 ' OE1' ' O ' ' X' ' 14' ' ' GLY . 5.0 mm-40 -134.17 150.88 51.12 Favored 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 110.139 -0.319 . . . . 0.0 110.139 179.689 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 2.3 m -148.02 129.43 14.83 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.278 178.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' X' X ' 17' ' ' THR . . . . . 0.558 HG23 ' O ' ' X' ' 3' ' ' TYR . 2.4 m -131.44 157.36 43.67 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 120.878 0.37 . . . . 0.0 110.546 179.835 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 18' ' ' THR . . . . . . . . . . . . . 7.5 t -149.52 152.96 36.44 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.019 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' X' X ' 19' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -103.93 105.81 16.12 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 179.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 20' ' ' ALA . . . . . . . . . . . . . . . -131.56 161.61 32.24 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 121.16 0.505 . . . . 0.0 111.235 -179.189 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' X' X ' 21' ' ' VAL . . . . . . . . . . . . . 1.2 p -87.02 -37.4 11.14 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.222 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.48 179.314 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' X' X ' 22' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -111.33 156.0 22.22 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.927 -179.416 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' X' X ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.99 -46.16 37.12 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.03 179.806 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' X' X ' 24' ' ' ALA . . . . . . . . . . . . . . . -62.41 -39.75 94.28 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.473 -179.011 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' X' X ' 25' ' ' THR . . . . . . . . . . . . . 1.1 t -64.14 -31.95 73.33 Favored 'General case' 0 C--N 1.345 0.393 0 C-N-CA 120.73 -0.388 . . . . 0.0 110.622 -179.609 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' X' X ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.03 -35.87 78.98 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.901 0.381 . . . . 0.0 110.651 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' X' X ' 27' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -61.76 -28.38 69.4 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.567 -179.775 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' X' X ' 28' ' ' LYS . . . . . . . . . . . . . 83.4 mttt -56.93 -43.1 81.12 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.178 -178.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' X' X ' 29' ' ' VAL . . . . . 0.427 ' O ' ' CB ' ' X' ' 33' ' ' TYR . 13.8 t -69.99 -51.19 42.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.533 179.298 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 30' ' ' PHE . . . . . . . . . . . . . 61.0 m-85 -61.91 -43.18 99.38 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.873 -179.301 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' X' X ' 31' ' ' LYS . . . . . . . . . . . . . 2.7 tppt? -66.34 -47.74 72.5 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 120.534 -0.466 . . . . 0.0 110.52 -179.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' X' X ' 32' ' ' GLN . . . . . . . . . . . . . 57.8 tp60 -71.81 -33.72 68.76 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.657 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' X' X ' 33' ' ' TYR . . . . . 0.427 ' CB ' ' O ' ' X' ' 29' ' ' VAL . 19.1 t80 -61.38 -30.52 70.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.478 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 34' ' ' ALA . . . . . 0.886 ' HB1' ' O ' ' X' ' 39' ' ' VAL . . . -59.32 -39.29 82.61 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.638 -178.6 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 35' ' ' ASN . . . . . . . . . . . . . 39.3 t-20 -69.06 -34.84 75.81 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 120.505 -0.478 . . . . 0.0 109.759 179.446 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' X' X ' 36' ' ' ASP . . . . . 0.508 ' OD1' ' N ' ' X' ' 36' ' ' ASP . 0.7 OUTLIER -67.28 -35.3 79.21 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 115.709 -0.678 . . . . 0.0 112.104 -179.538 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' X' X ' 37' ' ' ASN . . . . . 0.519 ' OD1' ' N ' ' X' ' 38' ' ' GLY . 24.6 p-10 -95.37 -25.17 16.39 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 120.86 -0.336 . . . . 0.0 111.512 -178.877 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 38' ' ' GLY . . . . . 0.519 ' N ' ' OD1' ' X' ' 37' ' ' ASN . . . 103.17 28.57 6.07 Favored Glycine 0 CA--C 1.534 1.238 0 CA-C-O 119.473 -0.626 . . . . 0.0 114.172 177.165 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 39' ' ' VAL . . . . . 0.886 ' O ' ' HB1' ' X' ' 34' ' ' ALA . 2.4 m -122.77 113.33 37.75 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 CA-C-N 118.201 1.001 . . . . 0.0 110.569 178.749 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 40' ' ' ASP . . . . . . . . . . . . . 19.0 t0 -127.35 108.01 10.48 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 179.799 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -145.19 -165.68 11.34 Favored Glycine 0 CA--C 1.531 1.065 0 N-CA-C 111.485 -0.646 . . . . 0.0 111.485 179.8 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' X' X ' 42' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -75.61 125.14 28.45 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 121.023 0.439 . . . . 0.0 110.429 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' X' X ' 43' ' ' TRP . . . . . . . . . . . . . 79.2 m95 -91.79 161.45 14.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.543 0.687 . . . . 0.0 111.59 -179.46 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' X' X ' 44' ' ' THR . . . . . 0.472 ' CG2' ' OG1' ' X' ' 53' ' ' THR . 9.1 t -156.91 167.57 30.08 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 114.617 -1.174 . . . . 0.0 108.497 179.162 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 45' ' ' TYR . . . . . 0.636 ' CD1' ' CE1' ' X' ' 52' ' ' PHE . 14.7 t80 -171.08 133.61 0.89 Allowed 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 119.458 -0.897 . . . . 0.0 112.062 -179.787 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 46' ' ' ASP . . . . . . . . . . . . . 12.7 t0 -123.95 112.39 17.15 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 177.627 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' X' X ' 47' ' ' ASP . . . . . 0.408 ' OD1' ' O ' ' X' ' 47' ' ' ASP . 10.1 t70 -67.19 -16.74 64.49 Favored 'General case' 0 C--O 1.231 0.106 0 CA-C-O 120.656 0.265 . . . . 0.0 110.997 -179.413 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.31 -12.97 59.93 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.138 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' X' X ' 49' ' ' THR . . . . . . . . . . . . . 2.6 p -128.16 2.93 5.81 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 110.526 -0.175 . . . . 0.0 110.526 -179.833 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' X' X ' 50' ' ' LYS . . . . . . . . . . . . . 68.5 mmtt 41.57 58.62 2.68 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 120.827 -0.349 . . . . 0.0 110.571 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' X' X ' 51' ' ' THR . . . . . . . . . . . . . 91.1 m -148.47 127.55 12.82 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 112.302 0.482 . . . . 0.0 112.302 -179.282 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' X' X ' 52' ' ' PHE . . . . . 0.636 ' CE1' ' CD1' ' X' ' 45' ' ' TYR . 19.4 m-85 -107.9 155.38 20.35 Favored 'General case' 0 C--N 1.344 0.357 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 178.318 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 53' ' ' THR . . . . . 0.472 ' OG1' ' CG2' ' X' ' 44' ' ' THR . 68.6 p -152.48 130.04 11.48 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 120.454 -0.498 . . . . 0.0 110.682 179.464 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 54' ' ' VAL . . . . . 0.503 ' O ' HG13 ' X' ' 54' ' ' VAL . 11.5 p -113.81 123.74 69.77 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 178.72 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 55' ' ' THR . . . . . 0.463 ' O ' HG23 ' X' ' 55' ' ' THR . 5.0 t -121.74 125.02 45.6 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.319 -178.412 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 56' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 . . . . . 0 C--O 1.22 -0.484 0 CA-C-O 117.955 -1.022 . . . . 0.0 110.348 179.765 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' X' X ' 2' ' ' GLN . . . . . . . . . . . . . 86.5 mt-30 . . . . . 0 N--CA 1.465 0.294 0 CA-C-O 121.006 0.431 . . . . 0.0 110.936 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' X' X ' 3' ' ' TYR . . . . . 0.54 ' O ' HG23 ' X' ' 17' ' ' THR . 60.6 m-85 -124.67 137.84 54.34 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.555 179.283 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 4' ' ' LYS . . . . . . . . . . . . . 10.0 ttmm -119.62 127.35 52.85 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 120.935 0.398 . . . . 0.0 110.303 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' X' X ' 5' ' ' LEU . . . . . 0.703 HD13 ' C ' ' X' ' 5' ' ' LEU . 1.0 OUTLIER -108.95 128.17 54.7 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 179.458 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' X' X ' 6' ' ' ILE . . . . . 0.547 ' N ' HD22 ' X' ' 5' ' ' LEU . 28.1 mm -98.45 132.12 44.2 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.485 0 CA-C-O 120.958 0.409 . . . . 0.0 109.954 -179.385 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 7' ' ' LEU . . . . . 0.439 HD21 HD22 ' X' ' 37' ' ' ASN . 6.2 mp -92.16 112.54 24.51 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.246 -179.221 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 8' ' ' ASN . . . . . 0.498 ' ND2' ' O ' ' X' ' 54' ' ' VAL . 2.9 p-10 -132.58 87.51 2.42 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.199 -1.038 . . . . 0.0 108.199 178.214 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 9' ' ' GLY . . . . . 0.559 ' H ' ' NZ ' ' X' ' 13' ' ' LYS . . . -122.85 -158.01 10.09 Favored Glycine 0 C--N 1.335 0.523 0 N-CA-C 111.201 -0.759 . . . . 0.0 111.201 -178.905 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 10' ' ' LYS . . . . . . . . . . . . . 70.2 mttt -73.64 -47.42 40.19 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.785 -0.366 . . . . 0.0 111.239 -179.534 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' X' X ' 11' ' ' THR . . . . . . . . . . . . . 41.6 p -130.62 -15.8 3.47 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 -179.384 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' X' X ' 12' ' ' LEU . . . . . 0.635 ' C ' ' HZ3' ' X' ' 13' ' ' LYS . 0.4 OUTLIER -99.36 112.96 25.04 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 120.762 0.315 . . . . 0.0 111.449 -178.672 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' X' X ' 13' ' ' LYS . . . . . 0.635 ' HZ3' ' C ' ' X' ' 12' ' ' LEU . 0.3 OUTLIER -135.01 139.2 44.66 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.103 179.265 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' X' X ' 14' ' ' GLY . . . . . 0.408 ' H ' ' HB2' ' X' ' 7' ' ' LEU . . . 174.38 -154.75 19.82 Favored Glycine 0 CA--C 1.535 1.305 0 N-CA-C 110.861 -0.896 . . . . 0.0 110.861 -179.749 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 15' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -133.39 150.29 51.8 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 120.731 0.3 . . . . 0.0 110.446 179.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 2.8 m -148.06 129.42 14.78 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.328 178.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' X' X ' 17' ' ' THR . . . . . 0.54 HG23 ' O ' ' X' ' 3' ' ' TYR . 2.4 m -130.28 156.86 43.95 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 120.961 0.41 . . . . 0.0 110.728 179.794 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 18' ' ' THR . . . . . . . . . . . . . 7.5 t -148.97 153.3 37.74 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.86 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' X' X ' 19' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -103.93 105.63 15.88 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.217 -0.447 . . . . 0.0 109.88 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' X' X ' 20' ' ' ALA . . . . . . . . . . . . . . . -136.71 163.46 30.55 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.741 -179.639 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' X' X ' 21' ' ' VAL . . . . . 0.445 ' H ' HG12 ' X' ' 21' ' ' VAL . 1.1 p -89.81 -40.7 13.2 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.279 0 CA-C-N 115.883 -0.599 . . . . 0.0 109.389 179.291 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 22' ' ' ASP . . . . . . . . . . . . . 37.1 m-20 -103.69 155.11 18.83 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.413 -179.157 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' X' X ' 23' ' ' ALA . . . . . . . . . . . . . . . -75.16 -45.97 37.29 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.925 179.657 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' X' X ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.81 -39.87 95.26 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.454 -179.049 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' X' X ' 25' ' ' THR . . . . . . . . . . . . . 1.2 t -63.55 -34.06 76.96 Favored 'General case' 0 C--N 1.346 0.423 0 C-N-CA 120.617 -0.433 . . . . 0.0 110.607 -179.53 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' X' X ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.25 -35.86 78.57 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.945 0.403 . . . . 0.0 110.568 179.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' X' X ' 27' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -60.02 -29.32 68.42 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.812 -179.493 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 28' ' ' LYS . . . . . . . . . . . . . 41.2 mtmt -56.03 -41.97 75.8 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 120.416 -0.513 . . . . 0.0 110.416 -178.7 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' X' X ' 29' ' ' VAL . . . . . 0.428 ' O ' ' CB ' ' X' ' 33' ' ' TYR . 11.5 t -70.26 -51.71 36.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-O 120.984 0.421 . . . . 0.0 110.526 179.337 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 30' ' ' PHE . . . . . . . . . . . . . 57.6 m-85 -61.96 -42.9 99.64 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.986 -179.188 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' X' X ' 31' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -61.66 -51.25 69.22 Favored 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 120.494 -0.482 . . . . 0.0 110.73 -179.47 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 32' ' ' GLN . . . . . . . . . . . . . 45.0 tt0 -73.48 -35.93 65.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.285 -179.606 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' X' X ' 33' ' ' TYR . . . . . 0.428 ' CB ' ' O ' ' X' ' 29' ' ' VAL . 70.0 t80 -61.8 -46.1 91.0 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.552 -0.294 . . . . 0.0 111.09 -179.388 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 34' ' ' ALA . . . . . 0.477 ' HB1' ' O ' ' X' ' 39' ' ' VAL . . . -59.16 -41.37 88.21 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.609 -0.437 . . . . 0.0 110.049 -179.287 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 35' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -60.46 -43.5 96.84 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 178.701 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' X' X ' 36' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -66.99 -26.48 66.82 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.342 179.048 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' X' X ' 37' ' ' ASN . . . . . 0.439 HD22 HD21 ' X' ' 7' ' ' LEU . 1.5 t-20 -83.77 -25.89 30.1 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.867 -178.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 38' ' ' GLY . . . . . . . . . . . . . . . 114.8 -37.52 3.49 Favored Glycine 0 CA--C 1.531 1.038 0 C-N-CA 121.559 -0.353 . . . . 0.0 112.285 178.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' X' X ' 39' ' ' VAL . . . . . 0.477 ' O ' ' HB1' ' X' ' 34' ' ' ALA . 1.4 p -80.55 108.75 14.26 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.305 0 CA-C-N 117.333 0.567 . . . . 0.0 111.107 -179.123 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 40' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -127.28 110.89 13.3 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 115.846 -0.616 . . . . 0.0 109.816 179.325 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' X' X ' 41' ' ' GLY . . . . . 0.485 ' H ' ' CG2' ' X' ' 54' ' ' VAL . . . -141.37 -157.36 7.14 Favored Glycine 0 CA--C 1.533 1.174 0 C-N-CA 120.764 -0.731 . . . . 0.0 111.927 -179.485 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 42' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -75.12 133.05 41.61 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 120.877 0.37 . . . . 0.0 110.254 -179.777 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' X' X ' 43' ' ' TRP . . . . . . . . . . . . . 82.0 m95 -98.02 161.5 13.69 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.734 0.778 . . . . 0.0 112.078 -178.75 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' X' X ' 44' ' ' THR . . . . . 0.499 ' CG2' ' OG1' ' X' ' 53' ' ' THR . 2.5 t -157.07 169.1 25.58 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 114.348 -1.297 . . . . 0.0 108.818 179.381 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 45' ' ' TYR . . . . . 0.627 ' CD1' ' CE1' ' X' ' 52' ' ' PHE . 7.0 t80 -173.38 135.14 0.54 Allowed 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 119.801 -0.76 . . . . 0.0 111.7 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 46' ' ' ASP . . . . . 0.401 ' N ' ' CD1' ' X' ' 45' ' ' TYR . 8.5 t0 -123.56 112.42 17.43 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 115.269 -0.878 . . . . 0.0 108.648 177.955 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 47' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -66.51 -14.65 62.57 Favored 'General case' 0 C--N 1.334 -0.101 0 CA-C-O 120.825 0.345 . . . . 0.0 110.714 -179.547 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' X' X ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.82 -13.19 59.59 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.149 -179.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' X' X ' 49' ' ' THR . . . . . . . . . . . . . 3.0 p -129.03 4.29 5.31 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 112.138 0.421 . . . . 0.0 112.138 -178.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' X' X ' 50' ' ' LYS . . . . . . . . . . . . . 11.3 mmpt? 44.9 56.0 5.65 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 119.76 -0.776 . . . . 0.0 110.654 -179.694 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' X' X ' 51' ' ' THR . . . . . . . . . . . . . 36.6 m -149.91 130.0 13.55 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 112.519 0.563 . . . . 0.0 112.519 -179.015 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' X' X ' 52' ' ' PHE . . . . . 0.627 ' CE1' ' CD1' ' X' ' 45' ' ' TYR . 14.0 m-85 -110.89 154.3 24.25 Favored 'General case' 0 C--N 1.346 0.442 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 178.236 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 53' ' ' THR . . . . . 0.499 ' OG1' ' CG2' ' X' ' 44' ' ' THR . 47.5 p -150.95 131.14 13.54 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 120.333 -0.547 . . . . 0.0 110.472 179.151 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 54' ' ' VAL . . . . . 0.498 ' O ' ' ND2' ' X' ' 8' ' ' ASN . 10.8 p -113.48 124.31 69.99 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 179.176 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 55' ' ' THR . . . . . 0.532 ' O ' HG23 ' X' ' 55' ' ' THR . 4.7 t -124.82 120.99 33.28 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 116.4 -0.363 . . . . 0.0 111.445 -178.594 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 56' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 . . . . . 0 C--O 1.22 -0.459 0 CA-C-O 117.917 -1.04 . . . . 0.0 110.208 179.389 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' X' X ' 2' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 . . . . . 0 N--CA 1.464 0.241 0 CA-C-O 120.998 0.427 . . . . 0.0 111.177 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' X' X ' 3' ' ' TYR . . . . . 0.451 ' O ' HG23 ' X' ' 17' ' ' THR . 64.5 m-85 -115.99 141.22 48.41 Favored 'General case' 0 CA--C 1.517 -0.308 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 178.733 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 4' ' ' LYS . . . . . . . . . . . . . 49.8 tttp -119.47 127.28 52.92 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 120.767 0.317 . . . . 0.0 110.34 -179.831 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' X' X ' 5' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -103.32 130.01 50.49 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.109 179.809 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 6' ' ' ILE . . . . . . . . . . . . . 32.6 mm -101.17 127.3 54.55 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.485 0 N-CA-C 109.349 -0.612 . . . . 0.0 109.349 178.07 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' X' X ' 7' ' ' LEU . . . . . 0.493 HD23 HD22 ' X' ' 12' ' ' LEU . 6.3 mp -93.45 112.11 23.93 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.502 -178.841 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 8' ' ' ASN . . . . . 0.558 ' N ' ' OD1' ' X' ' 8' ' ' ASN . 1.9 p-10 -134.59 87.61 2.37 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 178.237 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 9' ' ' GLY . . . . . 0.599 ' H ' ' NZ ' ' X' ' 13' ' ' LYS . . . -125.76 -157.4 9.6 Favored Glycine 0 C--N 1.336 0.543 0 N-CA-C 111.404 -0.678 . . . . 0.0 111.404 -178.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 10' ' ' LYS . . . . . . . . . . . . . 70.8 mttt -79.97 -49.18 12.21 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 121.059 -0.256 . . . . 0.0 111.543 -179.248 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' X' X ' 11' ' ' THR . . . . . . . . . . . . . 42.5 p -130.2 18.46 5.44 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -179.031 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' X' X ' 12' ' ' LEU . . . . . 0.794 ' H ' ' HZ1' ' X' ' 13' ' ' LYS . 0.4 OUTLIER -138.41 106.34 5.68 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 120.803 0.335 . . . . 0.0 110.905 -179.699 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' X' X ' 13' ' ' LYS . . . . . 0.794 ' HZ1' ' H ' ' X' ' 12' ' ' LEU . 0.2 OUTLIER -130.78 138.94 50.16 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.273 179.509 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' X' X ' 14' ' ' GLY . . . . . 0.427 ' O ' ' OE2' ' X' ' 15' ' ' GLU . . . 173.87 -155.4 21.79 Favored Glycine 0 CA--C 1.533 1.183 0 N-CA-C 111.158 -0.777 . . . . 0.0 111.158 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 15' ' ' GLU . . . . . 0.427 ' OE2' ' O ' ' X' ' 14' ' ' GLY . 6.6 mm-40 -134.11 151.98 51.63 Favored 'General case' 0 N--CA 1.465 0.291 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 179.609 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -147.75 141.67 25.85 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 179.142 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 17' ' ' THR . . . . . 0.451 HG23 ' O ' ' X' ' 3' ' ' TYR . 2.6 m -144.4 154.55 43.1 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 121.19 0.519 . . . . 0.0 110.978 179.651 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 18' ' ' THR . . . . . 0.52 HG22 ' CZ ' ' X' ' 30' ' ' PHE . 14.6 t -155.45 153.58 30.55 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.411 -179.845 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 19' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -103.65 105.61 15.89 Favored 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 179.791 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' X' X ' 20' ' ' ALA . . . . . . . . . . . . . . . -126.98 160.45 31.03 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.798 -179.678 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' X' X ' 21' ' ' VAL . . . . . 0.466 ' H ' HG12 ' X' ' 21' ' ' VAL . 1.0 OUTLIER -80.77 -41.4 19.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 N-CA-C 109.29 -0.634 . . . . 0.0 109.29 179.277 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' X' X ' 22' ' ' ASP . . . . . 0.42 ' OD1' ' N ' ' X' ' 22' ' ' ASP . 32.1 p-10 -127.99 161.47 29.08 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.573 -179.774 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.2 -35.19 63.93 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.028 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' X' X ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.63 -37.65 76.37 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.91 -178.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' X' X ' 25' ' ' THR . . . . . 0.402 ' CG2' ' OD1' ' X' ' 22' ' ' ASP . 1.5 t -75.23 -40.19 59.25 Favored 'General case' 0 C--N 1.345 0.376 0 CA-C-N 118.129 0.422 . . . . 0.0 111.239 -179.337 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.93 -35.58 78.67 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.849 0.356 . . . . 0.0 111.162 -179.448 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' X' X ' 27' ' ' GLU . . . . . 0.435 ' O ' ' CB ' ' X' ' 31' ' ' LYS . 1.6 pt-20 -59.59 -30.46 68.69 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.237 -179.235 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 28' ' ' LYS . . . . . . . . . . . . . 81.7 mttt -58.07 -48.83 78.93 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.307 -0.557 . . . . 0.0 110.326 -178.425 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' X' X ' 29' ' ' VAL . . . . . 0.43 ' O ' ' CB ' ' X' ' 33' ' ' TYR . 12.4 t -72.55 -51.72 27.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-O 121.189 0.518 . . . . 0.0 110.795 179.24 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 30' ' ' PHE . . . . . 0.52 ' CZ ' HG22 ' X' ' 18' ' ' THR . 4.6 m-30 -61.48 -43.18 99.33 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.828 -178.672 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 31' ' ' LYS . . . . . 0.435 ' CB ' ' O ' ' X' ' 27' ' ' GLU . 14.9 ttmt -66.65 -46.98 73.99 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.218 -0.593 . . . . 0.0 110.575 -179.892 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 32' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -73.49 -32.86 64.51 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.118 -179.862 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' X' X ' 33' ' ' TYR . . . . . 0.43 ' CB ' ' O ' ' X' ' 29' ' ' VAL . 58.1 t80 -60.66 -46.09 91.63 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.141 -178.922 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 34' ' ' ALA . . . . . 0.584 ' HB1' ' O ' ' X' ' 39' ' ' VAL . . . -60.17 -36.42 77.55 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.649 -0.421 . . . . 0.0 110.171 -179.733 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 35' ' ' ASN . . . . . . . . . . . . . 5.7 t30 -71.18 -44.49 65.35 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 179.416 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' X' X ' 36' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -67.39 -32.77 73.9 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.827 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' X' X ' 37' ' ' ASN . . . . . 0.563 ' OD1' ' N ' ' X' ' 38' ' ' GLY . 24.5 p30 -79.23 -24.3 43.16 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 120.474 -0.49 . . . . 0.0 111.328 -178.832 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 38' ' ' GLY . . . . . 0.563 ' N ' ' OD1' ' X' ' 37' ' ' ASN . . . 130.87 -44.41 1.21 Allowed Glycine 0 CA--C 1.532 1.134 0 C-N-CA 121.257 -0.497 . . . . 0.0 112.738 178.601 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 39' ' ' VAL . . . . . 0.584 ' O ' ' HB1' ' X' ' 34' ' ' ALA . 1.9 p -81.0 109.08 14.98 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 CA-C-N 117.403 0.601 . . . . 0.0 112.089 -178.114 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 40' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -128.19 111.02 12.98 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.49 178.813 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' X' X ' 41' ' ' GLY . . . . . 0.449 ' H ' ' CG2' ' X' ' 54' ' ' VAL . . . -143.52 -155.24 6.36 Favored Glycine 0 CA--C 1.533 1.202 0 C-N-CA 120.291 -0.957 . . . . 0.0 112.471 -179.298 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 42' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -74.37 141.64 45.13 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 -179.856 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' X' X ' 43' ' ' TRP . . . . . . . . . . . . . 83.6 m95 -104.99 162.37 13.41 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.897 0.856 . . . . 0.0 112.858 -177.829 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' X' X ' 44' ' ' THR . . . . . 0.498 ' CG2' ' OG1' ' X' ' 53' ' ' THR . 2.5 t -157.01 164.21 38.24 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 114.073 -1.421 . . . . 0.0 108.828 179.339 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 45' ' ' TYR . . . . . 0.62 ' CD1' ' CE1' ' X' ' 52' ' ' PHE . 3.0 t80 -175.03 134.53 0.34 Allowed 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 119.701 -0.8 . . . . 0.0 111.666 179.862 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 46' ' ' ASP . . . . . 0.514 ' N ' ' CD1' ' X' ' 45' ' ' TYR . 11.2 t0 -123.74 112.56 17.49 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 115.186 -0.916 . . . . 0.0 108.699 177.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 47' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -65.81 -15.63 63.06 Favored 'General case' 0 C--O 1.231 0.079 0 CA-C-O 120.698 0.285 . . . . 0.0 110.918 -179.674 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' X' X ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.33 -13.67 59.49 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.069 -179.729 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' X' X ' 49' ' ' THR . . . . . . . . . . . . . 2.7 p -128.29 3.14 5.73 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 121.436 -0.106 . . . . 0.0 110.725 -179.657 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' X' X ' 50' ' ' LYS . . . . . . . . . . . . . 68.6 mmtt 41.18 56.39 3.07 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 120.839 -0.344 . . . . 0.0 110.632 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' X' X ' 51' ' ' THR . . . . . . . . . . . . . 96.8 m -144.16 127.02 16.29 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 120.671 0.272 . . . . 0.0 111.456 -179.409 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' X' X ' 52' ' ' PHE . . . . . 0.62 ' CE1' ' CD1' ' X' ' 45' ' ' TYR . 15.9 m-85 -109.44 153.93 23.34 Favored 'General case' 0 C--N 1.343 0.295 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 179.109 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 53' ' ' THR . . . . . 0.498 ' OG1' ' CG2' ' X' ' 44' ' ' THR . 4.3 p -152.23 129.3 11.09 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 120.493 -0.483 . . . . 0.0 109.989 178.82 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 54' ' ' VAL . . . . . 0.473 ' O ' HG13 ' X' ' 54' ' ' VAL . 14.4 p -112.84 124.2 69.25 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 178.48 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 55' ' ' THR . . . . . 0.431 ' O ' HG23 ' X' ' 55' ' ' THR . 2.0 t -124.55 124.49 42.38 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.651 -178.085 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 56' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 . . . . . 0 C--O 1.221 -0.402 0 CA-C-O 117.968 -1.015 . . . . 0.0 110.09 179.465 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' X' X ' 2' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 . . . . . 0 N--CA 1.465 0.304 0 CA-C-O 120.879 0.371 . . . . 0.0 110.756 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' X' X ' 3' ' ' TYR . . . . . 0.537 ' O ' HG23 ' X' ' 17' ' ' THR . 92.0 m-85 -115.81 148.44 39.89 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.9 -0.591 . . . . 0.0 109.627 179.379 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 4' ' ' LYS . . . . . . . . . . . . . 45.5 tttp -119.27 127.81 53.58 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 120.927 0.394 . . . . 0.0 110.259 179.842 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' X' X ' 5' ' ' LEU . . . . . 0.706 HD13 ' C ' ' X' ' 5' ' ' LEU . 1.1 tm? -109.72 127.83 54.86 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.403 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 6' ' ' ILE . . . . . 0.518 ' N ' HD22 ' X' ' 5' ' ' LEU . 26.8 mm -98.91 132.34 44.41 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.349 0 CA-C-O 120.901 0.381 . . . . 0.0 110.15 -179.361 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 7' ' ' LEU . . . . . 0.435 HD21 HD22 ' X' ' 37' ' ' ASN . 6.3 mp -92.42 110.75 22.16 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.649 -179.131 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 8' ' ' ASN . . . . . 0.469 ' N ' ' OD1' ' X' ' 8' ' ' ASN . 6.3 p-10 -134.57 87.68 2.37 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 178.034 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 9' ' ' GLY . . . . . 0.821 ' H ' ' HZ1' ' X' ' 13' ' ' LYS . . . -123.89 -143.5 6.26 Favored Glycine 0 N--CA 1.464 0.552 0 N-CA-C 111.662 -0.575 . . . . 0.0 111.662 -179.158 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 10' ' ' LYS . . . . . . . . . . . . . 74.1 mttt -87.98 -53.17 4.87 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 111.818 0.303 . . . . 0.0 111.818 -179.274 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' X' X ' 11' ' ' THR . . . . . . . . . . . . . 41.4 p -130.29 21.83 5.23 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 -178.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' X' X ' 12' ' ' LEU . . . . . 0.777 ' C ' ' HZ2' ' X' ' 13' ' ' LYS . 0.6 OUTLIER -138.56 116.98 12.0 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 120.707 0.289 . . . . 0.0 110.725 -179.95 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' X' X ' 13' ' ' LYS . . . . . 0.821 ' HZ1' ' H ' ' X' ' 9' ' ' GLY . 0.3 OUTLIER -138.88 139.72 38.17 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.009 0.433 . . . . 0.0 110.749 179.889 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' X' X ' 14' ' ' GLY . . . . . 0.439 ' O ' ' OE1' ' X' ' 15' ' ' GLU . . . 174.17 -155.24 21.15 Favored Glycine 0 CA--C 1.533 1.17 0 N-CA-C 110.624 -0.991 . . . . 0.0 110.624 -179.913 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 15' ' ' GLU . . . . . 0.439 ' OE1' ' O ' ' X' ' 14' ' ' GLY . 5.2 mm-40 -133.83 150.87 51.42 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.863 0.332 . . . . 0.0 110.166 179.684 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 2.8 m -147.9 129.22 14.77 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 120.776 -0.37 . . . . 0.0 110.159 179.006 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' X' X ' 17' ' ' THR . . . . . 0.537 HG23 ' O ' ' X' ' 3' ' ' TYR . 2.5 m -130.69 156.79 44.33 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 120.989 0.423 . . . . 0.0 110.544 179.895 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 18' ' ' THR . . . . . . . . . . . . . 7.6 t -148.91 152.88 37.17 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 115.881 -0.599 . . . . 0.0 109.545 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' X' X ' 19' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -104.21 105.55 15.73 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 -179.679 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' X' X ' 20' ' ' ALA . . . . . . . . . . . . . . . -136.66 163.12 31.32 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.69 -179.579 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' X' X ' 21' ' ' VAL . . . . . 0.453 ' H ' HG12 ' X' ' 21' ' ' VAL . 1.1 p -88.56 -40.78 13.69 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.595 179.26 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 22' ' ' ASP . . . . . 0.426 ' OD1' ' N ' ' X' ' 23' ' ' ALA . 46.5 t0 -103.61 154.41 19.53 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.376 -179.247 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 23' ' ' ALA . . . . . 0.426 ' N ' ' OD1' ' X' ' 22' ' ' ASP . . . -75.08 -43.35 53.61 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.87 179.599 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.34 -39.79 94.59 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.595 -179.148 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' X' X ' 25' ' ' THR . . . . . . . . . . . . . 1.2 t -64.11 -34.2 77.51 Favored 'General case' 0 C--N 1.345 0.405 0 C-N-CA 120.665 -0.414 . . . . 0.0 110.572 -179.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' X' X ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.43 -35.88 78.26 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.877 0.37 . . . . 0.0 110.777 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' X' X ' 27' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -61.58 -28.02 69.05 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.859 -179.6 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' X' X ' 28' ' ' LYS . . . . . . . . . . . . . 83.8 mttt -56.8 -44.27 81.77 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.535 -0.466 . . . . 0.0 110.003 -179.025 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' X' X ' 29' ' ' VAL . . . . . 0.429 ' O ' ' CB ' ' X' ' 33' ' ' TYR . 11.5 t -70.15 -50.92 43.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.647 179.289 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 30' ' ' PHE . . . . . . . . . . . . . 55.0 m-85 -61.8 -43.53 98.67 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.111 -0.495 . . . . 0.0 112.009 -179.019 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' X' X ' 31' ' ' LYS . . . . . . . . . . . . . 67.5 mttt -70.47 -40.94 73.37 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 120.215 -0.594 . . . . 0.0 110.386 -179.627 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' X' X ' 32' ' ' GLN . . . . . . . . . . . . . 3.6 tp-100 -73.17 -33.55 65.52 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 179.168 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' X' X ' 33' ' ' TYR . . . . . 0.429 ' CB ' ' O ' ' X' ' 29' ' ' VAL . 29.2 t80 -66.76 -36.83 83.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.877 -179.848 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 34' ' ' ALA . . . . . 0.509 ' HB1' ' O ' ' X' ' 39' ' ' VAL . . . -59.38 -41.83 90.28 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.492 -179.188 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 35' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -66.67 -37.68 85.27 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 179.209 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 36' ' ' ASP . . . . . 0.491 ' OD1' ' N ' ' X' ' 36' ' ' ASP . 0.9 OUTLIER -67.71 -33.15 74.31 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.404 -0.816 . . . . 0.0 111.938 -179.908 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' X' X ' 37' ' ' ASN . . . . . 0.605 HD21 ' CG1' ' X' ' 39' ' ' VAL . 14.8 p-10 -90.59 -24.57 20.52 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 120.766 -0.374 . . . . 0.0 111.883 -178.301 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 38' ' ' GLY . . . . . 0.535 ' N ' ' OD1' ' X' ' 37' ' ' ASN . . . 118.92 -39.2 2.61 Favored Glycine 0 CA--C 1.533 1.2 0 C-N-CA 121.228 -0.51 . . . . 0.0 113.806 177.752 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 39' ' ' VAL . . . . . 0.605 ' CG1' HD21 ' X' ' 37' ' ' ASN . 1.5 p -80.24 108.29 13.51 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 CA-C-N 117.974 0.887 . . . . 0.0 111.549 -178.042 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 40' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -127.78 111.94 14.21 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 115.762 -0.654 . . . . 0.0 109.861 179.143 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' X' X ' 41' ' ' GLY . . . . . 0.524 ' H ' ' CG2' ' X' ' 54' ' ' VAL . . . -141.82 -154.96 6.3 Favored Glycine 0 CA--C 1.534 1.223 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.149 -179.464 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 42' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -74.98 137.34 41.5 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 110.092 -0.336 . . . . 0.0 110.092 -179.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' X' X ' 43' ' ' TRP . . . . . . . . . . . . . 82.1 m95 -102.97 161.88 13.39 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.767 0.794 . . . . 0.0 112.611 -178.45 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' X' X ' 44' ' ' THR . . . . . 0.481 ' CG2' ' OG1' ' X' ' 53' ' ' THR . 11.3 t -157.01 169.04 25.74 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.181 -1.372 . . . . 0.0 108.368 179.251 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 45' ' ' TYR . . . . . 0.612 ' CD1' ' CE1' ' X' ' 52' ' ' PHE . 3.0 t80 -174.43 135.27 0.42 Allowed 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 119.597 -0.841 . . . . 0.0 111.819 -179.951 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 46' ' ' ASP . . . . . 0.517 ' N ' ' CD1' ' X' ' 45' ' ' TYR . 14.8 t0 -123.68 112.5 17.46 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 115.206 -0.907 . . . . 0.0 108.804 177.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 47' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -66.56 -14.94 63.01 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-O 120.775 0.321 . . . . 0.0 110.831 -179.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' X' X ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.34 -14.53 58.92 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.082 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' X' X ' 49' ' ' THR . . . . . . . . . . . . . 2.7 p -128.27 3.33 5.74 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 121.475 -0.09 . . . . 0.0 110.888 -179.737 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' X' X ' 50' ' ' LYS . . . . . . . . . . . . . 68.7 mmtt 41.63 56.7 3.25 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 120.799 -0.36 . . . . 0.0 110.546 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' X' X ' 51' ' ' THR . . . . . . . . . . . . . 86.3 m -146.24 127.84 15.15 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 120.775 0.322 . . . . 0.0 111.828 -179.303 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' X' X ' 52' ' ' PHE . . . . . 0.612 ' CE1' ' CD1' ' X' ' 45' ' ' TYR . 11.0 m-85 -108.2 155.29 20.62 Favored 'General case' 0 C--N 1.343 0.301 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 178.725 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 53' ' ' THR . . . . . 0.481 ' OG1' ' CG2' ' X' ' 44' ' ' THR . 58.8 p -150.97 130.54 13.02 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 120.513 -0.475 . . . . 0.0 110.396 179.277 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 54' ' ' VAL . . . . . 0.524 ' CG2' ' H ' ' X' ' 41' ' ' GLY . 11.4 p -113.58 123.89 69.68 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.408 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 179.243 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 55' ' ' THR . . . . . 0.52 ' O ' HG23 ' X' ' 55' ' ' THR . 4.2 t -125.31 120.39 31.03 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.403 -178.715 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 56' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 . . . . . 0 C--O 1.219 -0.517 0 CA-C-O 118.117 -0.944 . . . . 0.0 110.094 179.567 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' X' X ' 2' ' ' GLN . . . . . . . . . . . . . 80.0 mt-30 . . . . . 0 N--CA 1.467 0.402 0 CA-C-O 120.961 0.41 . . . . 0.0 111.312 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' X' X ' 3' ' ' TYR . . . . . 0.636 ' CD1' ' N ' ' X' ' 3' ' ' TYR . 0.1 OUTLIER -119.87 168.74 10.81 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 178.866 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' X' X ' 4' ' ' LYS . . . . . . . . . . . . . 28.7 tttm -135.86 128.78 31.29 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 121.062 -0.255 . . . . 0.0 110.566 -179.829 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' X' X ' 5' ' ' LEU . . . . . 0.573 HD22 ' N ' ' X' ' 6' ' ' ILE . 1.7 tm? -105.79 126.26 51.96 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 179.633 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 6' ' ' ILE . . . . . 0.573 ' N ' HD22 ' X' ' 5' ' ' LEU . 32.9 mm -98.14 132.54 42.91 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.452 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 179.393 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 7' ' ' LEU . . . . . 0.502 HD23 HD22 ' X' ' 12' ' ' LEU . 5.7 mp -92.21 115.25 27.92 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.652 -179.536 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 8' ' ' ASN . . . . . . . . . . . . . 35.1 t30 -134.55 87.52 2.36 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 177.863 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' X' X ' 9' ' ' GLY . . . . . 0.529 ' H ' ' HD3' ' X' ' 13' ' ' LYS . . . -126.85 -163.0 11.37 Favored Glycine 0 C--N 1.336 0.541 0 N-CA-C 111.291 -0.724 . . . . 0.0 111.291 -179.096 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 10' ' ' LYS . . . . . . . . . . . . . 40.5 mtmt -80.55 -43.02 21.34 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.938 -0.305 . . . . 0.0 110.937 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' X' X ' 11' ' ' THR . . . . . . . . . . . . . 42.3 p -130.54 15.78 5.43 Favored 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 112.3 0.482 . . . . 0.0 112.3 -179.195 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' X' X ' 12' ' ' LEU . . . . . 0.664 ' N ' ' HZ2' ' X' ' 13' ' ' LYS . 0.3 OUTLIER -138.52 100.44 4.09 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 120.842 -0.343 . . . . 0.0 111.642 -179.526 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' X' X ' 13' ' ' LYS . . . . . 0.664 ' HZ2' ' N ' ' X' ' 12' ' ' LEU . 0.0 OUTLIER -122.44 137.77 54.76 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 178.829 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' X' X ' 14' ' ' GLY . . . . . . . . . . . . . . . 173.17 -154.6 20.85 Favored Glycine 0 CA--C 1.533 1.184 0 N-CA-C 111.082 -0.807 . . . . 0.0 111.082 -179.73 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' X' X ' 15' ' ' GLU . . . . . . . . . . . . . 56.8 mm-40 -131.8 152.74 50.76 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.595 0.236 . . . . 0.0 110.469 179.613 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -148.23 154.85 40.62 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 120.969 0.414 . . . . 0.0 110.441 179.716 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 17' ' ' THR . . . . . 0.594 HG23 ' O ' ' X' ' 3' ' ' TYR . 2.0 m -145.96 158.93 43.86 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.737 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 18' ' ' THR . . . . . . . . . . . . . 4.4 t -153.08 151.2 29.94 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-N 116.203 -0.453 . . . . 0.0 109.885 179.069 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' X' X ' 19' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -106.55 110.81 23.12 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.089 179.769 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 20' ' ' ALA . . . . . . . . . . . . . . . -147.57 162.12 39.75 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.055 0.455 . . . . 0.0 110.597 179.766 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' X' X ' 21' ' ' VAL . . . . . 0.448 HG12 ' H ' ' X' ' 21' ' ' VAL . 1.1 p -87.0 -41.38 14.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.717 179.561 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 22' ' ' ASP . . . . . . . . . . . . . 68.6 m-20 -103.86 151.82 22.66 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.482 -179.033 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' X' X ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.43 -37.46 63.31 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.298 -0.864 . . . . 0.0 110.872 179.735 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' X' X ' 24' ' ' ALA . . . . . . . . . . . . . . . -70.49 -38.23 74.33 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.332 -179.197 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' X' X ' 25' ' ' THR . . . . . . . . . . . . . 1.1 t -67.29 -29.82 69.52 Favored 'General case' 0 C--N 1.345 0.408 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.621 -179.835 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' X' X ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.55 -35.77 79.69 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.495 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' X' X ' 27' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -58.31 -30.4 66.63 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.579 -179.771 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' X' X ' 28' ' ' LYS . . . . . . . . . . . . . 41.7 mtmt -57.34 -39.52 76.09 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.472 -0.491 . . . . 0.0 110.181 -178.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' X' X ' 29' ' ' VAL . . . . . 0.415 ' O ' ' CB ' ' X' ' 33' ' ' TYR . 13.0 t -70.02 -51.47 39.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.543 179.33 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 30' ' ' PHE . . . . . . . . . . . . . 40.8 m-85 -64.59 -42.97 95.25 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.859 -179.412 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' X' X ' 31' ' ' LYS . . . . . . . . . . . . . 2.8 tppt? -61.46 -49.2 77.75 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 120.282 -0.567 . . . . 0.0 110.78 -179.478 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' X' X ' 32' ' ' GLN . . . . . . . . . . . . . 89.6 mt-30 -73.08 -38.36 66.44 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.838 -179.746 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' X' X ' 33' ' ' TYR . . . . . 0.528 ' CZ ' ' OD1' ' X' ' 37' ' ' ASN . 69.8 t80 -61.8 -37.47 84.51 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.645 -179.797 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 34' ' ' ALA . . . . . 0.474 ' HB1' ' O ' ' X' ' 39' ' ' VAL . . . -59.27 -38.06 79.17 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.39 -179.325 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 35' ' ' ASN . . . . . . . . . . . . . 10.0 m-20 -61.18 -48.17 82.78 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 179.504 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' X' X ' 36' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -66.81 -24.7 66.2 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.02 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' X' X ' 37' ' ' ASN . . . . . 0.528 ' OD1' ' CZ ' ' X' ' 33' ' ' TYR . 1.0 OUTLIER -87.27 -26.08 23.63 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 116.471 -0.332 . . . . 0.0 110.996 -178.943 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' X' X ' 38' ' ' GLY . . . . . . . . . . . . . . . 106.08 -36.91 4.1 Favored Glycine 0 CA--C 1.53 1.019 0 C-N-CA 121.359 -0.448 . . . . 0.0 112.563 178.626 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' X' X ' 39' ' ' VAL . . . . . 0.474 ' O ' ' HB1' ' X' ' 34' ' ' ALA . 3.1 p -79.96 107.74 12.68 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.39 0 CA-C-N 117.575 0.687 . . . . 0.0 110.983 -179.096 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 40' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -128.12 110.83 12.83 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.888 179.358 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' X' X ' 41' ' ' GLY . . . . . 0.513 ' H ' ' CG2' ' X' ' 54' ' ' VAL . . . -141.86 -155.72 6.56 Favored Glycine 0 CA--C 1.531 1.064 0 C-N-CA 120.683 -0.77 . . . . 0.0 111.943 -179.69 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 42' ' ' GLU . . . . . . . . . . . . . 10.9 mt-10 -74.99 133.62 41.65 Favored 'General case' 0 N--CA 1.446 -0.631 0 N-CA-C 110.129 -0.323 . . . . 0.0 110.129 -179.803 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' X' X ' 43' ' ' TRP . . . . . . . . . . . . . 90.6 m95 -99.19 162.36 13.1 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.476 0.655 . . . . 0.0 111.892 -178.541 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' X' X ' 44' ' ' THR . . . . . 0.507 ' CG2' ' OG1' ' X' ' 53' ' ' THR . 2.5 t -156.9 167.11 31.46 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 114.845 -1.071 . . . . 0.0 109.492 179.783 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 45' ' ' TYR . . . . . 0.63 ' CD1' ' CZ ' ' X' ' 52' ' ' PHE . 64.7 t80 -166.52 136.7 3.24 Favored 'General case' 0 CA--C 1.519 -0.241 0 C-N-CA 120.116 -0.634 . . . . 0.0 111.958 179.739 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 46' ' ' ASP . . . . . . . . . . . . . 18.8 t0 -123.44 111.79 16.76 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 177.523 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' X' X ' 47' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -67.11 -15.74 63.9 Favored 'General case' 0 C--O 1.231 0.095 0 CA-C-O 120.882 0.372 . . . . 0.0 110.751 -179.708 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' X' X ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.35 -18.09 53.17 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.115 -179.698 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' X' X ' 49' ' ' THR . . . . . . . . . . . . . 2.6 p -128.2 2.74 5.79 Favored 'General case' 0 N--CA 1.469 0.521 0 N-CA-C 110.626 -0.139 . . . . 0.0 110.626 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' X' X ' 50' ' ' LYS . . . . . . . . . . . . . 65.7 mmtt 39.64 55.69 2.39 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-O 120.583 0.23 . . . . 0.0 110.712 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' X' X ' 51' ' ' THR . . . . . . . . . . . . . 99.7 m -138.31 129.65 27.48 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.018 -179.6 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' X' X ' 52' ' ' PHE . . . . . 0.63 ' CZ ' ' CD1' ' X' ' 45' ' ' TYR . 87.3 m-85 -107.29 154.26 21.52 Favored 'General case' 0 C--N 1.342 0.281 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 179.46 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 53' ' ' THR . . . . . 0.507 ' OG1' ' CG2' ' X' ' 44' ' ' THR . 24.2 p -151.9 130.44 12.23 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 120.599 -0.44 . . . . 0.0 110.253 178.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 54' ' ' VAL . . . . . 0.513 ' CG2' ' H ' ' X' ' 41' ' ' GLY . 10.6 p -113.42 123.7 69.33 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 178.871 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 55' ' ' THR . . . . . 0.538 ' O ' HG23 ' X' ' 55' ' ' THR . 4.8 t -125.35 120.7 31.84 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.511 -178.425 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 56' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 . . . . . 0 C--O 1.22 -0.461 0 CA-C-O 118.073 -0.965 . . . . 0.0 110.136 179.252 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' X' X ' 2' ' ' GLN . . . . . . . . . . . . . 15.5 mm-40 . . . . . 0 N--CA 1.468 0.463 0 CA-C-O 121.049 0.452 . . . . 0.0 110.92 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' X' X ' 3' ' ' TYR . . . . . 0.533 ' O ' HG23 ' X' ' 17' ' ' THR . 38.1 m-85 -125.61 137.01 53.87 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.771 -0.65 . . . . 0.0 109.412 179.17 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 4' ' ' LYS . . . . . . . . . . . . . 44.8 tttp -119.97 128.06 53.22 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 120.923 0.392 . . . . 0.0 110.703 -179.821 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' X' X ' 5' ' ' LEU . . . . . 0.71 HD13 ' C ' ' X' ' 5' ' ' LEU . 1.0 OUTLIER -109.29 127.94 54.69 Favored 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 179.435 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' X' X ' 6' ' ' ILE . . . . . 0.537 ' N ' HD22 ' X' ' 5' ' ' LEU . 27.0 mm -98.99 132.35 44.51 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 CA-C-O 120.948 0.404 . . . . 0.0 110.176 -179.386 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 7' ' ' LEU . . . . . 0.406 ' HB2' ' H ' ' X' ' 14' ' ' GLY . 6.0 mp -92.66 110.24 21.66 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.664 -179.19 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 8' ' ' ASN . . . . . . . . . . . . . 12.7 t30 -132.91 87.52 2.41 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 178.298 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' X' X ' 9' ' ' GLY . . . . . 0.837 ' C ' ' HZ1' ' X' ' 13' ' ' LYS . . . -122.79 -147.35 7.39 Favored Glycine 0 N--CA 1.464 0.537 0 N-CA-C 111.462 -0.655 . . . . 0.0 111.462 -179.203 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 10' ' ' LYS . . . . . . . . . . . . . 57.1 mttt -79.17 -50.15 11.43 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 120.989 -0.284 . . . . 0.0 111.46 -179.486 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' X' X ' 11' ' ' THR . . . . . 0.436 ' C ' ' HZ3' ' X' ' 13' ' ' LYS . 41.5 p -130.35 -19.62 3.09 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 -179.427 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 12' ' ' LEU . . . . . 0.749 ' N ' ' HZ3' ' X' ' 13' ' ' LYS . 0.5 OUTLIER -92.15 119.51 31.87 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-O 120.648 0.261 . . . . 0.0 111.156 -178.943 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' X' X ' 13' ' ' LYS . . . . . 0.837 ' HZ1' ' C ' ' X' ' 9' ' ' GLY . 0.1 OUTLIER -140.18 139.24 35.66 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 120.907 0.384 . . . . 0.0 110.255 179.449 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' X' X ' 14' ' ' GLY . . . . . 0.438 ' O ' ' OE1' ' X' ' 15' ' ' GLU . . . 173.79 -155.01 21.13 Favored Glycine 0 CA--C 1.533 1.216 0 N-CA-C 110.671 -0.972 . . . . 0.0 110.671 -179.933 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 15' ' ' GLU . . . . . 0.438 ' OE1' ' O ' ' X' ' 14' ' ' GLY . 5.0 mm-40 -133.82 151.09 51.46 Favored 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 110.098 -0.334 . . . . 0.0 110.098 179.622 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 2.8 m -147.86 129.18 14.78 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.052 178.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' X' X ' 17' ' ' THR . . . . . 0.533 HG23 ' O ' ' X' ' 3' ' ' TYR . 2.4 m -129.47 157.05 43.08 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-O 121.003 0.43 . . . . 0.0 110.551 179.936 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 18' ' ' THR . . . . . . . . . . . . . 7.2 t -150.55 152.69 34.52 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.601 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' X' X ' 19' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -104.42 105.61 15.8 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.846 -0.427 . . . . 0.0 109.846 -179.626 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' X' X ' 20' ' ' ALA . . . . . . . . . . . . . . . -136.39 163.29 30.79 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.728 -179.668 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' X' X ' 21' ' ' VAL . . . . . 0.447 ' H ' HG12 ' X' ' 21' ' ' VAL . 1.1 p -89.04 -41.23 13.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.358 179.356 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 22' ' ' ASP . . . . . . . . . . . . . 46.5 t0 -102.27 152.71 20.74 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.335 -179.267 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' X' X ' 23' ' ' ALA . . . . . . . . . . . . . . . -75.14 -39.68 60.28 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.73 179.645 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' X' X ' 24' ' ' ALA . . . . . . . . . . . . . . . -67.51 -39.84 85.12 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.332 -179.087 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' X' X ' 25' ' ' THR . . . . . . . . . . . . . 1.2 t -64.24 -33.33 75.57 Favored 'General case' 0 C--N 1.345 0.409 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.62 -179.73 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' X' X ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.12 -35.99 79.01 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.973 0.416 . . . . 0.0 110.681 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' X' X ' 27' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -62.88 -28.43 70.03 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.594 -179.607 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' X' X ' 28' ' ' LYS . . . . . . . . . . . . . 83.5 mttt -57.17 -43.77 82.9 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 120.588 -0.445 . . . . 0.0 109.805 -179.163 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' X' X ' 29' ' ' VAL . . . . . 0.451 ' O ' ' N ' ' X' ' 33' ' ' TYR . 11.9 t -70.24 -50.88 43.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.588 179.296 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 30' ' ' PHE . . . . . . . . . . . . . 56.0 m-85 -61.76 -43.93 97.88 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.181 -0.463 . . . . 0.0 112.011 -179.236 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' X' X ' 31' ' ' LYS . . . . . . . . . . . . . 69.7 mttt -69.26 -41.76 76.48 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 120.173 -0.611 . . . . 0.0 110.281 -179.794 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' X' X ' 32' ' ' GLN . . . . . . . . . . . . . 59.6 tp60 -73.2 -33.14 65.22 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.038 0.447 . . . . 0.0 110.039 179.226 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' X' X ' 33' ' ' TYR . . . . . 0.451 ' N ' ' O ' ' X' ' 29' ' ' VAL . 69.3 t80 -71.23 -42.18 69.2 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.12 -179.794 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 34' ' ' ALA . . . . . 0.408 ' HB1' ' O ' ' X' ' 39' ' ' VAL . . . -58.73 -38.08 77.58 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 120.839 -0.344 . . . . 0.0 110.4 -179.09 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 35' ' ' ASN . . . . . . . . . . . . . 40.3 t-20 -63.19 -45.54 91.27 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 179.042 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' X' X ' 36' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -66.81 -25.02 66.25 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.622 179.415 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' X' X ' 37' ' ' ASN . . . . . 0.407 ' ND2' ' CE2' ' X' ' 33' ' ' TYR . 0.9 OUTLIER -85.09 -26.53 26.89 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.983 -178.839 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' X' X ' 38' ' ' GLY . . . . . . . . . . . . . . . 113.19 -37.91 3.43 Favored Glycine 0 CA--C 1.531 1.052 0 C-N-CA 121.541 -0.362 . . . . 0.0 112.973 178.354 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' X' X ' 39' ' ' VAL . . . . . 0.408 ' O ' ' HB1' ' X' ' 34' ' ' ALA . 1.5 p -80.63 108.64 14.22 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.394 0 CA-C-N 117.73 0.765 . . . . 0.0 111.161 -178.551 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 40' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -127.42 110.85 13.2 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.677 179.172 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' X' X ' 41' ' ' GLY . . . . . 0.502 ' H ' ' CG2' ' X' ' 54' ' ' VAL . . . -142.26 -155.17 6.35 Favored Glycine 0 CA--C 1.532 1.11 0 C-N-CA 120.606 -0.807 . . . . 0.0 111.981 -179.407 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 42' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -75.12 132.06 40.95 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-O 120.885 0.374 . . . . 0.0 110.152 -179.699 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' X' X ' 43' ' ' TRP . . . . . . . . . . . . . 81.5 m95 -97.92 161.41 13.75 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.65 0.738 . . . . 0.0 112.05 -178.672 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' X' X ' 44' ' ' THR . . . . . 0.502 ' CG2' ' OG1' ' X' ' 53' ' ' THR . 2.5 t -157.0 169.07 25.66 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 114.509 -1.223 . . . . 0.0 108.885 179.483 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 45' ' ' TYR . . . . . 0.615 ' CD1' ' CE1' ' X' ' 52' ' ' PHE . 2.6 t80 -173.9 135.55 0.5 Allowed 'General case' 0 C--N 1.331 -0.21 0 C-N-CA 119.697 -0.801 . . . . 0.0 111.691 -179.917 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 46' ' ' ASP . . . . . 0.539 ' N ' ' CD1' ' X' ' 45' ' ' TYR . 8.1 t0 -123.84 112.6 17.47 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 115.155 -0.929 . . . . 0.0 108.872 178.067 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 47' ' ' ASP . . . . . 0.422 ' OD1' ' OH ' ' X' ' 45' ' ' TYR . 25.0 t0 -66.47 -15.48 63.38 Favored 'General case' 0 C--O 1.23 0.057 0 CA-C-O 120.728 0.299 . . . . 0.0 110.856 -179.722 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.51 -14.88 58.57 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.069 -179.702 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' X' X ' 49' ' ' THR . . . . . . . . . . . . . 2.7 p -128.28 3.84 5.75 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 121.394 -0.122 . . . . 0.0 110.792 -179.656 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' X' X ' 50' ' ' LYS . . . . . . . . . . . . . 64.3 mmtt 40.89 57.34 2.74 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 120.922 -0.311 . . . . 0.0 110.693 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' X' X ' 51' ' ' THR . . . . . . . . . . . . . 85.1 m -146.62 127.88 14.81 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 120.725 0.298 . . . . 0.0 111.747 -179.435 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' X' X ' 52' ' ' PHE . . . . . 0.615 ' CE1' ' CD1' ' X' ' 45' ' ' TYR . 10.5 m-85 -107.64 154.11 21.92 Favored 'General case' 0 C--N 1.342 0.261 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 178.749 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 53' ' ' THR . . . . . 0.502 ' OG1' ' CG2' ' X' ' 44' ' ' THR . 36.4 p -150.97 130.36 12.88 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 120.447 -0.501 . . . . 0.0 110.187 179.07 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 54' ' ' VAL . . . . . 0.502 ' CG2' ' H ' ' X' ' 41' ' ' GLY . 14.4 p -113.51 123.92 69.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 179.192 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 55' ' ' THR . . . . . 0.507 ' O ' HG23 ' X' ' 55' ' ' THR . 4.3 t -125.24 121.38 33.91 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.525 -178.599 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 56' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 . . . . . 0 C--O 1.219 -0.533 0 CA-C-O 118.067 -0.968 . . . . 0.0 110.035 179.499 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' X' X ' 2' ' ' GLN . . . . . . . . . . . . . 83.6 mt-30 . . . . . 0 N--CA 1.465 0.314 0 CA-C-O 121.004 0.43 . . . . 0.0 111.51 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' X' X ' 3' ' ' TYR . . . . . 0.515 ' O ' HG23 ' X' ' 17' ' ' THR . 62.6 m-85 -116.93 139.63 50.42 Favored 'General case' 0 CA--C 1.517 -0.303 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 178.729 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 4' ' ' LYS . . . . . . . . . . . . . 52.3 tttp -120.93 127.83 52.19 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-O 120.911 0.386 . . . . 0.0 110.925 -179.3 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' X' X ' 5' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -105.01 129.0 53.56 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 179.08 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 6' ' ' ILE . . . . . . . . . . . . . 32.1 mm -100.94 129.79 51.31 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.419 0 N-CA-C 109.63 -0.508 . . . . 0.0 109.63 178.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' X' X ' 7' ' ' LEU . . . . . 0.407 ' HB2' ' H ' ' X' ' 14' ' ' GLY . 5.1 mp -93.43 110.04 21.61 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.771 -179.587 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 8' ' ' ASN . . . . . 0.523 ' N ' ' OD1' ' X' ' 8' ' ' ASN . 5.1 p-10 -134.83 87.36 2.33 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 178.039 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 9' ' ' GLY . . . . . 0.86 ' C ' ' HZ1' ' X' ' 13' ' ' LYS . . . -122.24 -145.84 7.13 Favored Glycine 0 N--CA 1.464 0.546 0 N-CA-C 111.527 -0.629 . . . . 0.0 111.527 -179.302 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 10' ' ' LYS . . . . . . . . . . . . . 41.2 mtmt -80.61 -49.49 11.21 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 121.157 -0.217 . . . . 0.0 111.551 -179.381 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' X' X ' 11' ' ' THR . . . . . 0.426 ' C ' ' HZ3' ' X' ' 13' ' ' LYS . 41.6 p -129.97 -19.45 3.24 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -179.34 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 12' ' ' LEU . . . . . 0.766 ' N ' ' HZ3' ' X' ' 13' ' ' LYS . 0.4 OUTLIER -93.12 119.18 32.05 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 120.624 0.249 . . . . 0.0 111.066 -178.954 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' X' X ' 13' ' ' LYS . . . . . 0.86 ' HZ1' ' C ' ' X' ' 9' ' ' GLY . 0.1 OUTLIER -141.52 139.21 33.19 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-O 120.974 0.416 . . . . 0.0 110.351 179.351 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' X' X ' 14' ' ' GLY . . . . . 0.438 ' O ' ' OE1' ' X' ' 15' ' ' GLU . . . 173.62 -155.11 21.52 Favored Glycine 0 CA--C 1.533 1.195 0 N-CA-C 110.771 -0.932 . . . . 0.0 110.771 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 15' ' ' GLU . . . . . 0.438 ' OE1' ' O ' ' X' ' 14' ' ' GLY . 6.6 mm-40 -129.72 154.64 46.97 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.85 0.357 . . . . 0.0 110.218 179.553 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -147.54 145.47 29.09 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.067 179.797 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 17' ' ' THR . . . . . 0.515 HG23 ' O ' ' X' ' 3' ' ' TYR . 1.8 m -146.11 157.25 43.84 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.943 0.401 . . . . 0.0 111.048 179.23 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 18' ' ' THR . . . . . . . . . . . . . 7.4 t -155.24 152.9 29.86 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.102 179.636 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' X' X ' 19' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -104.42 105.91 16.21 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 179.805 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 20' ' ' ALA . . . . . . . . . . . . . . . -130.64 159.01 38.48 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 121.107 0.48 . . . . 0.0 110.793 -179.849 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' X' X ' 21' ' ' VAL . . . . . 0.441 ' H ' HG12 ' X' ' 21' ' ' VAL . 1.0 OUTLIER -82.14 -41.09 17.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.316 179.118 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' X' X ' 22' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -111.56 157.3 20.53 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.131 -179.45 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' X' X ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.88 -42.92 56.93 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.659 -0.701 . . . . 0.0 111.133 179.849 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' X' X ' 24' ' ' ALA . . . . . . . . . . . . . . . -66.34 -41.38 89.66 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.563 -178.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' X' X ' 25' ' ' THR . . . . . . . . . . . . . 1.2 t -59.63 -35.61 74.72 Favored 'General case' 0 C--N 1.345 0.406 0 C-N-CA 120.734 -0.386 . . . . 0.0 110.716 -179.619 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' X' X ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.85 -35.02 77.84 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.924 0.392 . . . . 0.0 110.655 -179.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' X' X ' 27' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -57.25 -29.32 63.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.806 -179.317 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 28' ' ' LYS . . . . . . . . . . . . . 41.8 mtmt -57.34 -43.85 83.77 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.234 -178.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' X' X ' 29' ' ' VAL . . . . . 0.444 ' O ' ' CB ' ' X' ' 33' ' ' TYR . 19.1 t -69.47 -46.35 76.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.174 179.168 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 30' ' ' PHE . . . . . . . . . . . . . 8.4 m-30 -61.52 -43.41 98.91 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.308 -179.621 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' X' X ' 31' ' ' LYS . . . . . . . . . . . . . 2.4 tppt? -63.14 -50.1 71.76 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 120.335 -0.546 . . . . 0.0 110.763 -179.459 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' X' X ' 32' ' ' GLN . . . . . . . . . . . . . 93.7 mm-40 -73.52 -34.44 65.24 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.317 -179.659 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' X' X ' 33' ' ' TYR . . . . . 0.521 ' CZ ' ' OD1' ' X' ' 37' ' ' ASN . 69.0 t80 -61.74 -43.48 98.78 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.88 -179.535 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 34' ' ' ALA . . . . . 0.553 ' HB1' ' O ' ' X' ' 39' ' ' VAL . . . -59.11 -37.63 77.65 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.421 -179.082 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 35' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -64.18 -47.22 80.65 Favored 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 179.221 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' X' X ' 36' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -66.87 -26.08 66.72 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.645 179.602 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' X' X ' 37' ' ' ASN . . . . . 0.521 ' OD1' ' CZ ' ' X' ' 33' ' ' TYR . 1.1 m120 -84.0 -26.66 28.99 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.807 -179.283 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 38' ' ' GLY . . . . . . . . . . . . . . . 112.15 -39.25 2.93 Favored Glycine 0 CA--C 1.531 1.076 0 C-N-CA 121.555 -0.355 . . . . 0.0 112.364 178.622 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' X' X ' 39' ' ' VAL . . . . . 0.553 ' O ' ' HB1' ' X' ' 34' ' ' ALA . 1.6 p -80.78 108.75 14.46 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 CA-C-N 117.4 0.6 . . . . 0.0 111.211 -178.774 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 40' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -127.71 112.31 14.67 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.737 179.306 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' X' X ' 41' ' ' GLY . . . . . 0.469 ' H ' ' CG2' ' X' ' 54' ' ' VAL . . . -142.92 -153.73 5.96 Favored Glycine 0 CA--C 1.533 1.197 0 C-N-CA 120.337 -0.935 . . . . 0.0 112.283 -179.431 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 42' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -74.53 139.13 43.58 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 -179.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' X' X ' 43' ' ' TRP . . . . . . . . . . . . . 90.8 m95 -102.83 162.36 12.99 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.817 0.817 . . . . 0.0 112.686 -178.052 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' X' X ' 44' ' ' THR . . . . . 0.5 ' CG2' ' OG1' ' X' ' 53' ' ' THR . 2.8 t -156.9 167.85 29.23 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.35 -1.295 . . . . 0.0 108.821 179.206 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 45' ' ' TYR . . . . . 0.629 ' CD1' ' CE1' ' X' ' 52' ' ' PHE . 19.1 t80 -172.88 134.45 0.59 Allowed 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 119.748 -0.781 . . . . 0.0 111.771 179.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 46' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -123.66 112.33 17.27 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 115.25 -0.886 . . . . 0.0 108.708 177.87 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' X' X ' 47' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -68.61 -16.33 63.81 Favored 'General case' 0 C--O 1.231 0.121 0 CA-C-O 120.815 0.341 . . . . 0.0 110.988 -179.552 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' X' X ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.16 -13.56 59.64 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.101 -179.824 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' X' X ' 49' ' ' THR . . . . . . . . . . . . . 2.5 p -128.22 3.0 5.77 Favored 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 110.508 -0.182 . . . . 0.0 110.508 -179.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' X' X ' 50' ' ' LYS . . . . . . . . . . . . . 64.5 mmtt 41.54 57.48 2.99 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 120.908 -0.317 . . . . 0.0 110.544 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' X' X ' 51' ' ' THR . . . . . . . . . . . . . 96.9 m -147.01 128.67 15.17 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 111.891 0.33 . . . . 0.0 111.891 -179.346 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' X' X ' 52' ' ' PHE . . . . . 0.629 ' CE1' ' CD1' ' X' ' 45' ' ' TYR . 27.9 m-85 -107.84 156.23 19.39 Favored 'General case' 0 C--N 1.345 0.376 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 178.717 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 53' ' ' THR . . . . . 0.5 ' OG1' ' CG2' ' X' ' 44' ' ' THR . 11.6 p -152.14 128.83 10.82 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 178.767 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 54' ' ' VAL . . . . . 0.469 ' CG2' ' H ' ' X' ' 41' ' ' GLY . 10.4 p -112.74 123.98 68.95 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 178.776 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 55' ' ' THR . . . . . 0.471 ' O ' HG23 ' X' ' 55' ' ' THR . 3.0 t -124.93 123.27 39.54 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 116.561 -0.291 . . . . 0.0 111.708 -178.053 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 56' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 . . . . . 0 C--O 1.22 -0.494 0 CA-C-O 118.015 -0.993 . . . . 0.0 110.062 179.36 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' X' X ' 2' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 . . . . . 0 N--CA 1.465 0.304 0 CA-C-O 120.908 0.385 . . . . 0.0 110.622 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' X' X ' 3' ' ' TYR . . . . . 0.561 ' O ' HG23 ' X' ' 17' ' ' THR . 73.5 m-85 -115.3 142.66 46.38 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.463 179.462 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 4' ' ' LYS . . . . . . . . . . . . . 10.1 ttmm -119.45 127.2 52.86 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 121.024 0.44 . . . . 0.0 110.187 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' X' X ' 5' ' ' LEU . . . . . 0.708 HD13 ' C ' ' X' ' 5' ' ' LEU . 1.0 OUTLIER -107.8 127.64 53.89 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 179.664 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' X' X ' 6' ' ' ILE . . . . . 0.537 ' N ' HD22 ' X' ' 5' ' ' LEU . 29.2 mm -98.4 132.24 43.9 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.467 0 CA-C-O 120.907 0.384 . . . . 0.0 110.073 -179.474 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 7' ' ' LEU . . . . . 0.418 HD23 HD22 ' X' ' 12' ' ' LEU . 6.2 mp -91.91 113.62 25.94 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.283 -179.156 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 8' ' ' ASN . . . . . . . . . . . . . 20.2 t30 -131.78 87.73 2.48 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 178.165 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' X' X ' 9' ' ' GLY . . . . . 0.62 ' H ' ' NZ ' ' X' ' 13' ' ' LYS . . . -124.62 -163.24 11.62 Favored Glycine 0 N--CA 1.463 0.48 0 N-CA-C 111.542 -0.623 . . . . 0.0 111.542 -178.68 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 10' ' ' LYS . . . . . . . . . . . . . 55.5 mttt -75.94 -48.86 19.56 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 120.86 -0.336 . . . . 0.0 110.982 -179.692 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' X' X ' 11' ' ' THR . . . . . . . . . . . . . 41.3 p -130.73 19.3 5.12 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 112.177 0.436 . . . . 0.0 112.177 -179.301 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' X' X ' 12' ' ' LEU . . . . . 0.765 ' H ' ' HZ1' ' X' ' 13' ' ' LYS . 0.5 OUTLIER -138.4 108.12 6.26 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 120.848 0.356 . . . . 0.0 111.337 -179.435 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' X' X ' 13' ' ' LYS . . . . . 0.765 ' HZ1' ' H ' ' X' ' 12' ' ' LEU . 0.2 OUTLIER -131.78 139.94 49.06 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.264 179.429 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' X' X ' 14' ' ' GLY . . . . . 0.412 ' H ' ' HB2' ' X' ' 7' ' ' LEU . . . 174.6 -155.19 20.59 Favored Glycine 0 CA--C 1.535 1.323 0 N-CA-C 110.839 -0.905 . . . . 0.0 110.839 -179.794 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 15' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -134.4 149.94 50.84 Favored 'General case' 0 N--CA 1.468 0.449 0 O-C-N 122.717 -0.284 . . . . 0.0 110.517 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 2.7 m -148.28 129.5 14.64 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 120.88 -0.328 . . . . 0.0 110.343 178.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' X' X ' 17' ' ' THR . . . . . 0.561 HG23 ' O ' ' X' ' 3' ' ' TYR . 2.6 m -131.66 157.24 44.23 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 120.92 0.39 . . . . 0.0 110.451 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 18' ' ' THR . . . . . . . . . . . . . 7.1 t -152.67 152.81 32.17 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.087 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' X' X ' 19' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -104.2 105.86 16.16 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.785 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' X' X ' 20' ' ' ALA . . . . . . . . . . . . . . . -130.01 162.64 28.24 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.998 -179.336 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' X' X ' 21' ' ' VAL . . . . . 0.442 HG12 ' H ' ' X' ' 21' ' ' VAL . 1.2 p -82.98 -37.58 13.95 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.268 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.716 179.515 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 22' ' ' ASP . . . . . 0.509 ' OD1' ' N ' ' X' ' 23' ' ' ALA . 33.0 t0 -115.47 156.25 25.99 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.943 -179.532 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 23' ' ' ALA . . . . . 0.509 ' N ' ' OD1' ' X' ' 22' ' ' ASP . . . -74.94 -42.78 57.01 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.026 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 24' ' ' ALA . . . . . . . . . . . . . . . -65.71 -39.26 91.01 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.669 -179.054 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' X' X ' 25' ' ' THR . . . . . . . . . . . . . 1.2 t -63.21 -34.57 77.93 Favored 'General case' 0 C--N 1.346 0.437 0 C-N-CA 120.669 -0.413 . . . . 0.0 110.7 -179.561 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' X' X ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.0 -35.82 78.96 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.904 0.383 . . . . 0.0 110.73 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' X' X ' 27' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -58.27 -29.08 65.53 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.665 -179.779 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' X' X ' 28' ' ' LYS . . . . . 0.416 ' O ' ' OE1' ' X' ' 32' ' ' GLN . 41.4 mtmt -57.22 -43.49 82.86 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 120.456 -0.498 . . . . 0.0 110.031 -179.079 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 29' ' ' VAL . . . . . 0.43 ' O ' ' CB ' ' X' ' 33' ' ' TYR . 12.1 t -69.95 -50.76 45.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.459 179.394 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 30' ' ' PHE . . . . . . . . . . . . . 57.9 m-85 -61.54 -43.15 99.39 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.878 -179.319 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' X' X ' 31' ' ' LYS . . . . . . . . . . . . . 68.1 mttt -70.52 -41.78 72.14 Favored 'General case' 0 C--O 1.232 0.155 0 C-N-CA 120.23 -0.588 . . . . 0.0 110.55 -179.499 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' X' X ' 32' ' ' GLN . . . . . 0.416 ' OE1' ' O ' ' X' ' 28' ' ' LYS . 79.2 mt-30 -73.14 -33.52 65.55 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.02 0.438 . . . . 0.0 109.853 179.218 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 33' ' ' TYR . . . . . 0.43 ' CB ' ' O ' ' X' ' 29' ' ' VAL . 27.2 t80 -64.98 -37.62 88.24 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.518 179.844 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 34' ' ' ALA . . . . . 0.52 ' HB1' ' O ' ' X' ' 39' ' ' VAL . . . -59.68 -40.18 86.98 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.611 -179.456 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 35' ' ' ASN . . . . . . . . . . . . . 9.6 m-80 -68.24 -38.44 81.85 Favored 'General case' 0 N--CA 1.456 -0.151 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 179.326 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' X' X ' 36' ' ' ASP . . . . . 0.477 ' OD1' ' N ' ' X' ' 36' ' ' ASP . 0.9 OUTLIER -67.51 -32.15 72.76 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 115.492 -0.776 . . . . 0.0 112.055 -179.866 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' X' X ' 37' ' ' ASN . . . . . 0.623 HD21 ' CG1' ' X' ' 39' ' ' VAL . 17.8 p-10 -91.78 -24.73 19.32 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 -178.431 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 38' ' ' GLY . . . . . 0.543 ' N ' ' OD1' ' X' ' 37' ' ' ASN . . . 118.55 -37.98 3.04 Favored Glycine 0 CA--C 1.534 1.278 0 C-N-CA 121.236 -0.507 . . . . 0.0 113.886 177.726 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 39' ' ' VAL . . . . . 0.623 ' CG1' HD21 ' X' ' 37' ' ' ASN . 1.5 p -80.16 108.39 13.56 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 CA-C-N 118.009 0.905 . . . . 0.0 111.442 -178.064 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 40' ' ' ASP . . . . . . . . . . . . . 22.0 t0 -127.79 111.76 14.01 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.907 179.267 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' X' X ' 41' ' ' GLY . . . . . 0.514 ' H ' ' CG2' ' X' ' 54' ' ' VAL . . . -141.23 -155.37 6.46 Favored Glycine 0 CA--C 1.534 1.27 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.038 -179.589 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 42' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -75.0 136.76 41.25 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-O 120.702 0.287 . . . . 0.0 110.266 -179.682 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' X' X ' 43' ' ' TRP . . . . . . . . . . . . . 82.4 m95 -103.23 162.01 13.33 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.898 0.856 . . . . 0.0 112.535 -178.3 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' X' X ' 44' ' ' THR . . . . . 0.475 ' CG2' ' OG1' ' X' ' 53' ' ' THR . 9.0 t -157.06 166.99 31.76 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 114.071 -1.422 . . . . 0.0 108.384 179.103 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 45' ' ' TYR . . . . . 0.629 ' CE1' ' CE1' ' X' ' 52' ' ' PHE . 16.8 t80 -172.46 133.78 0.65 Allowed 'General case' 0 C--N 1.332 -0.195 0 C-N-CA 119.607 -0.837 . . . . 0.0 112.079 179.943 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 46' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -123.9 112.47 17.29 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 115.125 -0.943 . . . . 0.0 108.482 177.673 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' X' X ' 47' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -67.69 -16.29 64.07 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-O 120.672 0.272 . . . . 0.0 111.068 -179.388 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' X' X ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.35 -14.81 58.73 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.141 -179.77 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' X' X ' 49' ' ' THR . . . . . . . . . . . . . 2.8 p -125.73 2.8 7.48 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 110.44 -0.208 . . . . 0.0 110.44 -179.866 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' X' X ' 50' ' ' LYS . . . . . . . . . . . . . 67.0 mmtt 41.61 58.46 2.74 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 120.884 -0.326 . . . . 0.0 110.551 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' X' X ' 51' ' ' THR . . . . . . . . . . . . . 97.4 m -147.71 126.69 12.8 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 112.132 0.419 . . . . 0.0 112.132 -179.34 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' X' X ' 52' ' ' PHE . . . . . 0.629 ' CE1' ' CE1' ' X' ' 45' ' ' TYR . 26.8 m-85 -107.92 155.55 20.18 Favored 'General case' 0 C--N 1.344 0.352 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 178.436 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 53' ' ' THR . . . . . 0.475 ' OG1' ' CG2' ' X' ' 44' ' ' THR . 47.0 p -151.98 129.49 11.43 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 120.401 -0.52 . . . . 0.0 110.492 179.202 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 54' ' ' VAL . . . . . 0.514 ' CG2' ' H ' ' X' ' 41' ' ' GLY . 10.7 p -113.69 123.62 69.53 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.497 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 178.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 55' ' ' THR . . . . . 0.542 ' O ' HG23 ' X' ' 55' ' ' THR . 4.9 t -125.46 119.89 29.46 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.299 -178.716 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 56' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 . . . . . 0 C--O 1.219 -0.507 0 CA-C-O 118.009 -0.996 . . . . 0.0 110.088 179.635 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' X' X ' 2' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 . . . . . 0 N--CA 1.464 0.263 0 CA-C-O 120.908 0.385 . . . . 0.0 110.972 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' X' X ' 3' ' ' TYR . . . . . 0.524 ' O ' HG23 ' X' ' 17' ' ' THR . 61.3 m-85 -122.36 137.68 54.77 Favored 'General case' 0 CA--C 1.518 -0.259 0 CA-C-N 115.835 -0.621 . . . . 0.0 109.495 179.213 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 4' ' ' LYS . . . . . . . . . . . . . 45.3 tttp -119.58 127.62 53.14 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 120.978 0.418 . . . . 0.0 110.721 -179.639 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' X' X ' 5' ' ' LEU . . . . . 0.695 HD13 ' C ' ' X' ' 5' ' ' LEU . 1.0 OUTLIER -108.76 127.77 54.3 Favored 'General case' 0 N--CA 1.464 0.271 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 179.077 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' X' X ' 6' ' ' ILE . . . . . 0.531 ' N ' HD22 ' X' ' 5' ' ' LEU . 29.1 mm -98.12 132.57 42.81 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.46 0 CA-C-O 121.137 0.494 . . . . 0.0 110.006 -179.207 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 7' ' ' LEU . . . . . 0.475 HD23 HD22 ' X' ' 12' ' ' LEU . 6.0 mp -91.65 115.26 27.9 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.443 -178.922 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 8' ' ' ASN . . . . . . . . . . . . . 21.4 t30 -134.28 86.95 2.31 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 108.045 -1.095 . . . . 0.0 108.045 177.578 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' X' X ' 9' ' ' GLY . . . . . 0.516 ' H ' ' HD3' ' X' ' 13' ' ' LYS . . . -125.97 -163.36 11.53 Favored Glycine 0 C--N 1.335 0.479 0 N-CA-C 111.506 -0.638 . . . . 0.0 111.506 -178.871 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 10' ' ' LYS . . . . . . . . . . . . . 57.8 mttt -76.97 -46.98 22.15 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.973 -0.291 . . . . 0.0 111.155 -179.655 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' X' X ' 11' ' ' THR . . . . . . . . . . . . . 42.1 p -130.57 18.33 5.26 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 -179.26 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' X' X ' 12' ' ' LEU . . . . . 0.657 ' N ' ' HZ2' ' X' ' 13' ' ' LYS . 0.3 OUTLIER -138.59 100.4 4.07 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 120.87 -0.332 . . . . 0.0 111.52 -179.632 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' X' X ' 13' ' ' LYS . . . . . 0.657 ' HZ2' ' N ' ' X' ' 12' ' ' LEU . 0.0 OUTLIER -122.21 137.56 54.79 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 178.895 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' X' X ' 14' ' ' GLY . . . . . 0.435 ' O ' ' OE1' ' X' ' 15' ' ' GLU . . . 173.44 -155.16 21.8 Favored Glycine 0 CA--C 1.534 1.271 0 N-CA-C 110.923 -0.871 . . . . 0.0 110.923 -179.902 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 15' ' ' GLU . . . . . 0.435 ' OE1' ' O ' ' X' ' 14' ' ' GLY . 5.1 mm-40 -134.73 150.64 50.6 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 110.061 -0.348 . . . . 0.0 110.061 179.615 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 1.9 m -148.08 129.67 14.99 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.301 178.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' X' X ' 17' ' ' THR . . . . . 0.524 HG23 ' O ' ' X' ' 3' ' ' TYR . 2.3 m -129.41 157.21 42.6 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 120.98 0.419 . . . . 0.0 110.608 179.858 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 18' ' ' THR . . . . . . . . . . . . . 7.4 t -149.26 153.31 37.38 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.85 -179.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' X' X ' 19' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -103.81 105.67 15.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.218 -0.446 . . . . 0.0 109.847 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' X' X ' 20' ' ' ALA . . . . . . . . . . . . . . . -136.28 161.97 34.3 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.635 -179.695 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' X' X ' 21' ' ' VAL . . . . . 0.422 ' H ' HG12 ' X' ' 21' ' ' VAL . 1.1 p -87.3 -40.79 14.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.44 179.345 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 22' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -104.75 155.78 18.58 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.402 -179.163 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' X' X ' 23' ' ' ALA . . . . . . . . . . . . . . . -75.09 -45.94 37.93 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.943 179.772 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' X' X ' 24' ' ' ALA . . . . . . . . . . . . . . . -62.88 -40.22 96.85 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.518 -179.059 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' X' X ' 25' ' ' THR . . . . . . . . . . . . . 1.2 t -63.28 -33.06 74.68 Favored 'General case' 0 C--N 1.346 0.432 0 O-C-N 122.016 -0.428 . . . . 0.0 110.716 -179.706 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' X' X ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.1 -35.84 78.8 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.88 0.371 . . . . 0.0 110.581 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' X' X ' 27' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -62.46 -28.57 69.91 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.509 -179.733 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' X' X ' 28' ' ' LYS . . . . . 0.418 ' O ' ' OE1' ' X' ' 32' ' ' GLN . 84.0 mttt -57.51 -43.88 84.6 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.255 -0.429 . . . . 0.0 109.885 -179.012 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 29' ' ' VAL . . . . . 0.441 ' O ' ' CB ' ' X' ' 33' ' ' TYR . 13.1 t -70.03 -50.27 49.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.498 179.366 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 30' ' ' PHE . . . . . . . . . . . . . 55.9 m-85 -61.67 -43.53 98.67 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.831 -179.363 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' X' X ' 31' ' ' LYS . . . . . . . . . . . . . 72.0 mttt -69.5 -42.14 75.13 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 120.352 -0.539 . . . . 0.0 110.49 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' X' X ' 32' ' ' GLN . . . . . 0.418 ' OE1' ' O ' ' X' ' 28' ' ' LYS . 79.6 mt-30 -73.21 -33.24 65.26 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.044 0.45 . . . . 0.0 109.954 179.371 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 33' ' ' TYR . . . . . 0.524 ' CZ ' ' OD1' ' X' ' 37' ' ' ASN . 65.9 t80 -68.31 -36.97 80.13 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.704 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.23 -38.51 80.15 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.43 -179.23 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' X' X ' 35' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -60.85 -48.09 83.4 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 109.835 -0.432 . . . . 0.0 109.835 179.39 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' X' X ' 36' ' ' ASP . . . . . 0.407 ' OD1' ' N ' ' X' ' 36' ' ' ASP . 1.6 m-20 -66.87 -24.44 66.12 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.977 179.554 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 37' ' ' ASN . . . . . 0.524 ' OD1' ' CZ ' ' X' ' 33' ' ' TYR . 1.0 OUTLIER -86.62 -26.81 24.21 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.082 -178.702 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' X' X ' 38' ' ' GLY . . . . . . . . . . . . . . . 106.48 -34.98 5.34 Favored Glycine 0 CA--C 1.532 1.146 0 C-N-CA 121.343 -0.456 . . . . 0.0 112.915 178.499 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' X' X ' 39' ' ' VAL . . . . . 0.426 HG12 ' H ' ' X' ' 39' ' ' VAL . 2.1 p -80.4 107.88 13.23 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 CA-C-N 117.728 0.764 . . . . 0.0 110.873 -178.831 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 40' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -127.8 110.83 12.99 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 115.789 -0.642 . . . . 0.0 109.964 179.551 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' X' X ' 41' ' ' GLY . . . . . 0.513 ' H ' ' CG2' ' X' ' 54' ' ' VAL . . . -141.28 -155.39 6.46 Favored Glycine 0 CA--C 1.532 1.115 0 C-N-CA 120.763 -0.732 . . . . 0.0 111.769 -179.541 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 42' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -75.08 131.14 40.34 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 120.94 0.4 . . . . 0.0 110.202 -179.792 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' X' X ' 43' ' ' TRP . . . . . . . . . . . . . 83.6 m95 -97.38 161.42 13.8 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.651 0.739 . . . . 0.0 112.101 -178.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' X' X ' 44' ' ' THR . . . . . 0.5 ' CG2' ' OG1' ' X' ' 53' ' ' THR . 2.5 t -157.05 167.95 28.91 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.559 -1.2 . . . . 0.0 108.786 179.33 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 45' ' ' TYR . . . . . 0.635 ' CD1' ' CE1' ' X' ' 52' ' ' PHE . 22.1 t80 -170.56 134.23 1.08 Allowed 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 119.7 -0.8 . . . . 0.0 111.856 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 46' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -123.73 112.38 17.28 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 115.145 -0.934 . . . . 0.0 108.646 177.748 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' X' X ' 47' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -68.45 -16.39 63.88 Favored 'General case' 0 C--O 1.231 0.096 0 CA-C-O 120.716 0.294 . . . . 0.0 110.998 -179.419 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' X' X ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.35 -13.55 59.55 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.068 -179.748 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' X' X ' 49' ' ' THR . . . . . . . . . . . . . 2.6 p -128.19 2.95 5.79 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 110.647 -0.131 . . . . 0.0 110.647 -179.768 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' X' X ' 50' ' ' LYS . . . . . . . . . . . . . 64.2 mmtt 41.87 57.47 3.14 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 120.754 -0.378 . . . . 0.0 110.442 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' X' X ' 51' ' ' THR . . . . . . . . . . . . . 94.5 m -147.26 128.3 14.58 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 112.06 0.392 . . . . 0.0 112.06 -179.309 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' X' X ' 52' ' ' PHE . . . . . 0.635 ' CE1' ' CD1' ' X' ' 45' ' ' TYR . 29.2 m-85 -107.81 154.82 20.99 Favored 'General case' 0 C--N 1.343 0.325 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 178.561 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 53' ' ' THR . . . . . 0.5 ' OG1' ' CG2' ' X' ' 44' ' ' THR . 34.2 p -151.42 129.1 11.53 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 120.531 -0.467 . . . . 0.0 110.312 179.126 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 54' ' ' VAL . . . . . 0.513 ' CG2' ' H ' ' X' ' 41' ' ' GLY . 12.5 p -113.57 123.81 69.59 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.448 0 N-CA-C 109.381 -0.599 . . . . 0.0 109.381 179.01 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 55' ' ' THR . . . . . 0.554 ' O ' HG23 ' X' ' 55' ' ' THR . 5.3 t -125.45 120.3 30.62 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.399 -178.469 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 56' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 . . . . . 0 C--O 1.22 -0.481 0 CA-C-O 117.971 -1.014 . . . . 0.0 110.137 179.298 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' X' X ' 2' ' ' GLN . . . . . . . . . . . . . 24.8 mt-30 . . . . . 0 N--CA 1.467 0.383 0 CA-C-O 121.278 0.561 . . . . 0.0 111.659 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' X' X ' 3' ' ' TYR . . . . . 0.523 ' O ' HG23 ' X' ' 17' ' ' THR . 63.2 m-85 -123.39 143.98 49.77 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-N 115.287 -0.87 . . . . 0.0 108.769 178.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 4' ' ' LYS . . . . . . . . . . . . . 5.1 tttm -119.43 128.65 54.22 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 121.053 0.454 . . . . 0.0 111.118 -179.117 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' X' X ' 5' ' ' LEU . . . . . 0.709 HD13 ' C ' ' X' ' 5' ' ' LEU . 1.0 OUTLIER -108.93 128.27 54.78 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.283 179.697 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' X' X ' 6' ' ' ILE . . . . . 0.542 ' N ' HD22 ' X' ' 5' ' ' LEU . 26.5 mm -98.88 132.73 43.62 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.439 0 CA-C-O 121.043 0.449 . . . . 0.0 110.144 -179.272 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 7' ' ' LEU . . . . . 0.481 HD21 HD22 ' X' ' 37' ' ' ASN . 6.3 mp -92.09 108.78 20.19 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.36 -179.088 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 8' ' ' ASN . . . . . . . . . . . . . 11.9 t30 -131.2 87.72 2.51 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 178.621 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' X' X ' 9' ' ' GLY . . . . . 0.812 ' C ' ' HZ1' ' X' ' 13' ' ' LYS . . . -123.04 -147.4 7.36 Favored Glycine 0 N--CA 1.464 0.533 0 N-CA-C 111.505 -0.638 . . . . 0.0 111.505 -179.139 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 10' ' ' LYS . . . . . . . . . . . . . 48.5 mttt -77.78 -51.76 10.0 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 121.054 -0.258 . . . . 0.0 111.435 -179.453 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' X' X ' 11' ' ' THR . . . . . 0.444 ' C ' ' HZ3' ' X' ' 13' ' ' LYS . 41.5 p -130.53 -19.4 3.05 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 112.193 0.442 . . . . 0.0 112.193 -179.408 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 12' ' ' LEU . . . . . 0.779 ' N ' ' HZ3' ' X' ' 13' ' ' LYS . 0.6 OUTLIER -91.37 118.63 30.69 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 120.753 0.311 . . . . 0.0 111.165 -178.803 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' X' X ' 13' ' ' LYS . . . . . 0.812 ' HZ1' ' C ' ' X' ' 9' ' ' GLY . 0.1 OUTLIER -139.26 139.97 37.55 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 120.989 0.423 . . . . 0.0 110.434 179.65 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' X' X ' 14' ' ' GLY . . . . . 0.418 ' H ' ' HB2' ' X' ' 7' ' ' LEU . . . 174.45 -154.72 19.65 Favored Glycine 0 CA--C 1.534 1.27 0 N-CA-C 110.871 -0.891 . . . . 0.0 110.871 -179.777 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 15' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -134.24 151.01 51.07 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 120.677 0.275 . . . . 0.0 110.297 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 2.7 m -147.68 129.43 15.17 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.027 178.838 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' X' X ' 17' ' ' THR . . . . . 0.523 HG23 ' O ' ' X' ' 3' ' ' TYR . 2.0 m -130.77 158.57 39.78 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 120.903 0.382 . . . . 0.0 110.818 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 18' ' ' THR . . . . . . . . . . . . . 6.3 t -154.25 153.29 31.48 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.463 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' X' X ' 19' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -103.85 113.12 26.41 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 179.653 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' X' X ' 20' ' ' ALA . . . . . . . . . . . . . . . -137.34 161.09 37.22 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.018 -179.544 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' X' X ' 21' ' ' VAL . . . . . 0.454 ' H ' HG12 ' X' ' 21' ' ' VAL . 1.1 p -80.83 -39.82 18.3 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.335 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.58 179.331 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 22' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -116.94 156.79 26.81 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.999 -179.432 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' X' X ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.77 -41.31 60.29 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.962 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' X' X ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.18 -36.37 83.86 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.617 -179.126 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' X' X ' 25' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -70.23 -31.77 69.34 Favored 'General case' 0 C--N 1.345 0.384 0 O-C-N 122.091 -0.381 . . . . 0.0 110.795 -179.609 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.03 -35.52 78.4 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.974 0.416 . . . . 0.0 110.703 -179.825 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' X' X ' 27' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -57.61 -29.04 64.19 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.866 -179.565 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 28' ' ' LYS . . . . . . . . . . . . . 41.0 mtmt -56.0 -42.41 76.34 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 120.391 -0.524 . . . . 0.0 110.497 -178.685 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' X' X ' 29' ' ' VAL . . . . . . . . . . . . . 12.1 t -70.12 -51.16 41.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-O 120.889 0.376 . . . . 0.0 110.505 179.283 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' X' X ' 30' ' ' PHE . . . . . . . . . . . . . 60.2 m-85 -61.97 -42.43 99.12 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.971 -179.29 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' X' X ' 31' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -63.06 -51.31 67.17 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 120.738 -0.385 . . . . 0.0 111.075 -179.305 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 32' ' ' GLN . . . . . 0.408 ' O ' ' OD1' ' X' ' 36' ' ' ASP . 79.6 mt-30 -72.09 -32.86 67.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.139 -179.489 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 33' ' ' TYR . . . . . . . . . . . . . 29.1 t80 -60.9 -34.79 75.21 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.873 -179.406 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' X' X ' 34' ' ' ALA . . . . . 0.606 ' HB1' ' O ' ' X' ' 39' ' ' VAL . . . -59.9 -43.55 94.76 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.33 -179.414 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 35' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -66.84 -36.22 81.83 Favored 'General case' 0 N--CA 1.447 -0.621 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 179.4 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 36' ' ' ASP . . . . . 0.494 ' OD1' ' N ' ' X' ' 36' ' ' ASP . 0.7 OUTLIER -67.38 -31.05 71.02 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.893 -179.857 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' X' X ' 37' ' ' ASN . . . . . 0.608 HD21 ' CG1' ' X' ' 39' ' ' VAL . 15.8 p-10 -95.57 -24.58 16.54 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 111.951 0.352 . . . . 0.0 111.951 -178.528 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 38' ' ' GLY . . . . . 0.533 ' N ' ' OD1' ' X' ' 37' ' ' ASN . . . 121.24 -41.06 1.97 Allowed Glycine 0 CA--C 1.532 1.155 0 C-N-CA 121.308 -0.472 . . . . 0.0 113.514 177.957 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 39' ' ' VAL . . . . . 0.608 ' CG1' HD21 ' X' ' 37' ' ' ASN . 1.5 p -80.19 108.57 13.77 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.325 0 CA-C-N 117.735 0.767 . . . . 0.0 111.597 -178.149 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 40' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -127.74 111.54 13.79 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.881 179.084 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' X' X ' 41' ' ' GLY . . . . . 0.513 ' H ' ' CG2' ' X' ' 54' ' ' VAL . . . -141.48 -156.07 6.69 Favored Glycine 0 CA--C 1.534 1.232 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.077 -179.501 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 42' ' ' GLU . . . . . 0.604 ' CD ' ' H ' ' X' ' 42' ' ' GLU . 2.5 mp0 -75.14 139.12 42.5 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-O 120.743 0.306 . . . . 0.0 110.251 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 43' ' ' TRP . . . . . . . . . . . . . 81.3 m95 -103.86 163.47 12.33 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.866 0.841 . . . . 0.0 112.679 -178.262 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' X' X ' 44' ' ' THR . . . . . 0.48 ' CG2' ' OG1' ' X' ' 53' ' ' THR . 10.4 t -156.98 167.07 31.57 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 114.125 -1.398 . . . . 0.0 108.341 178.955 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 45' ' ' TYR . . . . . 0.623 ' CD1' ' CZ ' ' X' ' 52' ' ' PHE . 27.5 t80 -171.72 135.44 0.87 Allowed 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 119.603 -0.839 . . . . 0.0 111.858 -179.935 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 46' ' ' ASP . . . . . . . . . . . . . 11.7 t0 -123.29 112.44 17.63 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 177.785 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' X' X ' 47' ' ' ASP . . . . . . . . . . . . . 49.2 t0 -64.6 -15.67 61.5 Favored 'General case' 0 C--N 1.334 -0.076 0 CA-C-N 116.661 -0.245 . . . . 0.0 111.518 -179.143 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' X' X ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.99 -36.15 36.42 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 120.872 -0.331 . . . . 0.0 111.538 -179.494 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' X' X ' 49' ' ' THR . . . . . . . . . . . . . 2.8 p -102.84 2.91 36.04 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 110.632 -0.136 . . . . 0.0 110.632 -179.534 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' X' X ' 50' ' ' LYS . . . . . . . . . . . . . 14.0 mmmt 41.89 56.53 3.43 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 120.68 0.276 . . . . 0.0 110.412 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' X' X ' 51' ' ' THR . . . . . . . . . . . . . 39.0 m -144.32 129.49 18.67 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 -179.241 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' X' X ' 52' ' ' PHE . . . . . 0.623 ' CZ ' ' CD1' ' X' ' 45' ' ' TYR . 53.1 m-85 -108.31 153.77 22.76 Favored 'General case' 0 C--N 1.344 0.342 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 178.524 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 53' ' ' THR . . . . . 0.48 ' OG1' ' CG2' ' X' ' 44' ' ' THR . 65.9 p -151.23 130.12 12.47 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 120.522 -0.471 . . . . 0.0 110.476 179.185 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 54' ' ' VAL . . . . . 0.513 ' CG2' ' H ' ' X' ' 41' ' ' GLY . 11.2 p -113.53 123.98 69.72 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 179.21 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 55' ' ' THR . . . . . 0.516 ' O ' HG23 ' X' ' 55' ' ' THR . 4.2 t -125.34 120.68 31.81 Favored 'General case' 0 N--CA 1.474 0.725 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.351 -178.719 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 56' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 . . . . . 0 C--O 1.22 -0.463 0 CA-C-O 117.983 -1.008 . . . . 0.0 110.027 179.607 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' X' X ' 1' ' ' MET . . . . . 0.589 ' SD ' ' CZ ' ' X' ' 3' ' ' TYR . 0.1 OUTLIER . . . . . 0 N--CA 1.493 1.685 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 2' ' ' GLN . . . . . . . . . . . . . 29.7 mt-30 -125.6 147.96 49.12 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 121.162 0.506 . . . . 0.0 111.072 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 3' ' ' TYR . . . . . 0.589 ' CZ ' ' SD ' ' X' ' 1' ' ' MET . 72.8 m-85 -115.66 143.1 45.84 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.447 179.341 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 4' ' ' LYS . . . . . . . . . . . . . 45.7 tttp -119.6 127.14 52.67 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 120.964 0.412 . . . . 0.0 110.331 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 5' ' ' LEU . . . . . 0.698 HD13 ' C ' ' X' ' 5' ' ' LEU . 1.0 OUTLIER -107.59 127.11 53.35 Favored 'General case' 0 N--CA 1.465 0.276 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 179.471 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' X' X ' 6' ' ' ILE . . . . . 0.535 ' N ' HD22 ' X' ' 5' ' ' LEU . 27.2 mm -98.43 132.91 42.59 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.493 0 CA-C-O 121.231 0.539 . . . . 0.0 109.78 -179.365 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 7' ' ' LEU . . . . . 0.453 HD23 HD22 ' X' ' 12' ' ' LEU . 6.0 mp -91.83 107.72 19.41 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.848 -178.617 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 8' ' ' ASN . . . . . 0.492 ' ND2' ' O ' ' X' ' 54' ' ' VAL . 1.7 p-10 -125.76 85.85 2.45 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 107.045 -1.465 . . . . 0.0 107.045 176.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 9' ' ' GLY . . . . . 0.69 ' C ' ' HZ1' ' X' ' 13' ' ' LYS . . . -116.06 -162.67 13.26 Favored Glycine 0 C--N 1.334 0.439 0 N-CA-C 111.271 -0.732 . . . . 0.0 111.271 -178.785 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 10' ' ' LYS . . . . . . . . . . . . . 48.1 mttt -66.67 -54.5 22.47 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 120.523 -0.471 . . . . 0.0 110.753 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 11' ' ' THR . . . . . . . . . . . . . 42.6 p -130.88 -8.78 3.94 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 120.692 0.282 . . . . 0.0 111.208 179.843 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 12' ' ' LEU . . . . . 0.496 ' O ' ' NZ ' ' X' ' 13' ' ' LYS . 0.6 OUTLIER -95.93 114.69 26.44 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.107 -178.713 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' X' X ' 13' ' ' LYS . . . . . 0.69 ' HZ1' ' C ' ' X' ' 9' ' ' GLY . 0.3 OUTLIER -135.54 142.56 45.4 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-O 120.942 0.401 . . . . 0.0 110.723 179.66 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' X' X ' 14' ' ' GLY . . . . . 0.432 ' O ' ' OE1' ' X' ' 15' ' ' GLU . . . 174.27 -158.03 26.22 Favored Glycine 0 CA--C 1.533 1.205 0 N-CA-C 110.937 -0.865 . . . . 0.0 110.937 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 15' ' ' GLU . . . . . 0.432 ' OE1' ' O ' ' X' ' 14' ' ' GLY . 5.0 mm-40 -134.17 150.88 51.12 Favored 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 110.139 -0.319 . . . . 0.0 110.139 179.689 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 2.3 m -148.02 129.43 14.83 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.278 178.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 17' ' ' THR . . . . . 0.558 HG23 ' O ' ' X' ' 3' ' ' TYR . 2.4 m -131.44 157.36 43.67 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 120.878 0.37 . . . . 0.0 110.546 179.835 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 18' ' ' THR . . . . . . . . . . . . . 7.5 t -149.52 152.96 36.44 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.019 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 19' ' ' GLU . . . . . 0.422 ' OE2' ' O ' ' X' ' 1' ' ' MET . 0.0 OUTLIER -103.93 105.81 16.12 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 179.924 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' X' X ' 20' ' ' ALA . . . . . . . . . . . . . . . -131.56 161.61 32.24 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 121.16 0.505 . . . . 0.0 111.235 -179.189 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 21' ' ' VAL . . . . . . . . . . . . . 1.2 p -87.02 -37.4 11.14 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.222 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.48 179.314 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 22' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -111.33 156.0 22.22 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.927 -179.416 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.99 -46.16 37.12 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.03 179.806 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 24' ' ' ALA . . . . . . . . . . . . . . . -62.41 -39.75 94.28 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.473 -179.011 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 25' ' ' THR . . . . . . . . . . . . . 1.1 t -64.14 -31.95 73.33 Favored 'General case' 0 C--N 1.345 0.393 0 C-N-CA 120.73 -0.388 . . . . 0.0 110.622 -179.609 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.03 -35.87 78.98 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.901 0.381 . . . . 0.0 110.651 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 27' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -61.76 -28.38 69.4 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.567 -179.775 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 28' ' ' LYS . . . . . . . . . . . . . 83.4 mttt -56.93 -43.1 81.12 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.178 -178.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 29' ' ' VAL . . . . . 0.427 ' O ' ' CB ' ' X' ' 33' ' ' TYR . 13.8 t -69.99 -51.19 42.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.533 179.298 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 30' ' ' PHE . . . . . . . . . . . . . 61.0 m-85 -61.91 -43.18 99.38 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.873 -179.301 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 31' ' ' LYS . . . . . . . . . . . . . 2.7 tppt? -66.34 -47.74 72.5 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 120.534 -0.466 . . . . 0.0 110.52 -179.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 32' ' ' GLN . . . . . . . . . . . . . 57.8 tp60 -71.81 -33.72 68.76 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.657 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 33' ' ' TYR . . . . . 0.427 ' CB ' ' O ' ' X' ' 29' ' ' VAL . 19.1 t80 -61.38 -30.52 70.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.478 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 34' ' ' ALA . . . . . 0.886 ' HB1' ' O ' ' X' ' 39' ' ' VAL . . . -59.32 -39.29 82.61 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.638 -178.6 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 35' ' ' ASN . . . . . . . . . . . . . 39.3 t-20 -69.06 -34.84 75.81 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 120.505 -0.478 . . . . 0.0 109.759 179.446 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 36' ' ' ASP . . . . . 0.508 ' OD1' ' N ' ' X' ' 36' ' ' ASP . 0.7 OUTLIER -67.28 -35.3 79.21 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 115.709 -0.678 . . . . 0.0 112.104 -179.538 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' X' X ' 37' ' ' ASN . . . . . 0.519 ' OD1' ' N ' ' X' ' 38' ' ' GLY . 24.6 p-10 -95.37 -25.17 16.39 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 120.86 -0.336 . . . . 0.0 111.512 -178.877 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 38' ' ' GLY . . . . . 0.519 ' N ' ' OD1' ' X' ' 37' ' ' ASN . . . 103.17 28.57 6.07 Favored Glycine 0 CA--C 1.534 1.238 0 CA-C-O 119.473 -0.626 . . . . 0.0 114.172 177.165 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 39' ' ' VAL . . . . . 0.886 ' O ' ' HB1' ' X' ' 34' ' ' ALA . 2.4 m -122.77 113.33 37.75 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 CA-C-N 118.201 1.001 . . . . 0.0 110.569 178.749 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 40' ' ' ASP . . . . . . . . . . . . . 19.0 t0 -127.35 108.01 10.48 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 179.799 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -145.19 -165.68 11.34 Favored Glycine 0 CA--C 1.531 1.065 0 N-CA-C 111.485 -0.646 . . . . 0.0 111.485 179.8 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 42' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -75.61 125.14 28.45 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 121.023 0.439 . . . . 0.0 110.429 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 43' ' ' TRP . . . . . . . . . . . . . 79.2 m95 -91.79 161.45 14.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.543 0.687 . . . . 0.0 111.59 -179.46 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 44' ' ' THR . . . . . 0.472 ' CG2' ' OG1' ' X' ' 53' ' ' THR . 9.1 t -156.91 167.57 30.08 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 114.617 -1.174 . . . . 0.0 108.497 179.162 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 45' ' ' TYR . . . . . 0.636 ' CD1' ' CE1' ' X' ' 52' ' ' PHE . 14.7 t80 -171.08 133.61 0.89 Allowed 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 119.458 -0.897 . . . . 0.0 112.062 -179.787 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 46' ' ' ASP . . . . . . . . . . . . . 12.7 t0 -123.95 112.39 17.15 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 177.627 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 47' ' ' ASP . . . . . 0.408 ' OD1' ' O ' ' X' ' 47' ' ' ASP . 10.1 t70 -67.19 -16.74 64.49 Favored 'General case' 0 C--O 1.231 0.106 0 CA-C-O 120.656 0.265 . . . . 0.0 110.997 -179.413 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.31 -12.97 59.93 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.138 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 49' ' ' THR . . . . . . . . . . . . . 2.6 p -128.16 2.93 5.81 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 110.526 -0.175 . . . . 0.0 110.526 -179.833 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 50' ' ' LYS . . . . . . . . . . . . . 68.5 mmtt 41.57 58.62 2.68 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 120.827 -0.349 . . . . 0.0 110.571 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 51' ' ' THR . . . . . . . . . . . . . 91.1 m -148.47 127.55 12.82 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 112.302 0.482 . . . . 0.0 112.302 -179.282 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 52' ' ' PHE . . . . . 0.636 ' CE1' ' CD1' ' X' ' 45' ' ' TYR . 19.4 m-85 -107.9 155.38 20.35 Favored 'General case' 0 C--N 1.344 0.357 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 178.318 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 53' ' ' THR . . . . . 0.472 ' OG1' ' CG2' ' X' ' 44' ' ' THR . 68.6 p -152.48 130.04 11.48 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 120.454 -0.498 . . . . 0.0 110.682 179.464 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 54' ' ' VAL . . . . . 0.503 ' O ' HG13 ' X' ' 54' ' ' VAL . 11.5 p -113.81 123.74 69.77 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 178.72 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 55' ' ' THR . . . . . 0.463 ' O ' HG23 ' X' ' 55' ' ' THR . 5.0 t -121.74 125.02 45.6 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.319 -178.412 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 56' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 . . . . . 0 C--O 1.22 -0.484 0 CA-C-O 117.955 -1.022 . . . . 0.0 110.348 179.765 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' X' X ' 1' ' ' MET . . . . . 0.48 ' CE ' ' OH ' ' X' ' 3' ' ' TYR . 0.1 OUTLIER . . . . . 0 N--CA 1.493 1.717 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 2' ' ' GLN . . . . . . . . . . . . . 86.5 mt-30 -126.94 146.7 50.22 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 121.006 0.431 . . . . 0.0 110.936 -179.762 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 3' ' ' TYR . . . . . 0.54 ' O ' HG23 ' X' ' 17' ' ' THR . 60.6 m-85 -124.67 137.84 54.34 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.555 179.283 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 4' ' ' LYS . . . . . . . . . . . . . 10.0 ttmm -119.62 127.35 52.85 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 120.935 0.398 . . . . 0.0 110.303 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 5' ' ' LEU . . . . . 0.703 HD13 ' C ' ' X' ' 5' ' ' LEU . 1.0 OUTLIER -108.95 128.17 54.7 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 179.458 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' X' X ' 6' ' ' ILE . . . . . 0.547 ' N ' HD22 ' X' ' 5' ' ' LEU . 28.1 mm -98.45 132.12 44.2 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.485 0 CA-C-O 120.958 0.409 . . . . 0.0 109.954 -179.385 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 7' ' ' LEU . . . . . 0.439 HD21 HD22 ' X' ' 37' ' ' ASN . 6.2 mp -92.16 112.54 24.51 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.246 -179.221 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 8' ' ' ASN . . . . . 0.498 ' ND2' ' O ' ' X' ' 54' ' ' VAL . 2.9 p-10 -132.58 87.51 2.42 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.199 -1.038 . . . . 0.0 108.199 178.214 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 9' ' ' GLY . . . . . 0.559 ' H ' ' NZ ' ' X' ' 13' ' ' LYS . . . -122.85 -158.01 10.09 Favored Glycine 0 C--N 1.335 0.523 0 N-CA-C 111.201 -0.759 . . . . 0.0 111.201 -178.905 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 10' ' ' LYS . . . . . . . . . . . . . 70.2 mttt -73.64 -47.42 40.19 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.785 -0.366 . . . . 0.0 111.239 -179.534 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 11' ' ' THR . . . . . . . . . . . . . 41.6 p -130.62 -15.8 3.47 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 -179.384 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 12' ' ' LEU . . . . . 0.635 ' C ' ' HZ3' ' X' ' 13' ' ' LYS . 0.4 OUTLIER -99.36 112.96 25.04 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 120.762 0.315 . . . . 0.0 111.449 -178.672 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' X' X ' 13' ' ' LYS . . . . . 0.635 ' HZ3' ' C ' ' X' ' 12' ' ' LEU . 0.3 OUTLIER -135.01 139.2 44.66 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.103 179.265 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' X' X ' 14' ' ' GLY . . . . . 0.408 ' H ' ' HB2' ' X' ' 7' ' ' LEU . . . 174.38 -154.75 19.82 Favored Glycine 0 CA--C 1.535 1.305 0 N-CA-C 110.861 -0.896 . . . . 0.0 110.861 -179.749 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 15' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -133.39 150.29 51.8 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 120.731 0.3 . . . . 0.0 110.446 179.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 2.8 m -148.06 129.42 14.78 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.328 178.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 17' ' ' THR . . . . . 0.54 HG23 ' O ' ' X' ' 3' ' ' TYR . 2.4 m -130.28 156.86 43.95 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 120.961 0.41 . . . . 0.0 110.728 179.794 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 18' ' ' THR . . . . . . . . . . . . . 7.5 t -148.97 153.3 37.74 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.86 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 19' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -103.93 105.63 15.88 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.217 -0.447 . . . . 0.0 109.88 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 20' ' ' ALA . . . . . . . . . . . . . . . -136.71 163.46 30.55 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.741 -179.639 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 21' ' ' VAL . . . . . 0.445 ' H ' HG12 ' X' ' 21' ' ' VAL . 1.1 p -89.81 -40.7 13.2 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.279 0 CA-C-N 115.883 -0.599 . . . . 0.0 109.389 179.291 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 22' ' ' ASP . . . . . . . . . . . . . 37.1 m-20 -103.69 155.11 18.83 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.413 -179.157 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 23' ' ' ALA . . . . . . . . . . . . . . . -75.16 -45.97 37.29 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.925 179.657 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.81 -39.87 95.26 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.454 -179.049 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 25' ' ' THR . . . . . . . . . . . . . 1.2 t -63.55 -34.06 76.96 Favored 'General case' 0 C--N 1.346 0.423 0 C-N-CA 120.617 -0.433 . . . . 0.0 110.607 -179.53 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.25 -35.86 78.57 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.945 0.403 . . . . 0.0 110.568 179.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 27' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -60.02 -29.32 68.42 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.812 -179.493 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 28' ' ' LYS . . . . . . . . . . . . . 41.2 mtmt -56.03 -41.97 75.8 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 120.416 -0.513 . . . . 0.0 110.416 -178.7 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 29' ' ' VAL . . . . . 0.428 ' O ' ' CB ' ' X' ' 33' ' ' TYR . 11.5 t -70.26 -51.71 36.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-O 120.984 0.421 . . . . 0.0 110.526 179.337 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 30' ' ' PHE . . . . . . . . . . . . . 57.6 m-85 -61.96 -42.9 99.64 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.986 -179.188 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 31' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -61.66 -51.25 69.22 Favored 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 120.494 -0.482 . . . . 0.0 110.73 -179.47 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 32' ' ' GLN . . . . . . . . . . . . . 45.0 tt0 -73.48 -35.93 65.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.285 -179.606 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 33' ' ' TYR . . . . . 0.428 ' CB ' ' O ' ' X' ' 29' ' ' VAL . 70.0 t80 -61.8 -46.1 91.0 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.552 -0.294 . . . . 0.0 111.09 -179.388 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 34' ' ' ALA . . . . . 0.477 ' HB1' ' O ' ' X' ' 39' ' ' VAL . . . -59.16 -41.37 88.21 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.609 -0.437 . . . . 0.0 110.049 -179.287 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 35' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -60.46 -43.5 96.84 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 178.701 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 36' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -66.99 -26.48 66.82 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.342 179.048 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 37' ' ' ASN . . . . . 0.439 HD22 HD21 ' X' ' 7' ' ' LEU . 1.5 t-20 -83.77 -25.89 30.1 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.867 -178.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 38' ' ' GLY . . . . . . . . . . . . . . . 114.8 -37.52 3.49 Favored Glycine 0 CA--C 1.531 1.038 0 C-N-CA 121.559 -0.353 . . . . 0.0 112.285 178.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 39' ' ' VAL . . . . . 0.477 ' O ' ' HB1' ' X' ' 34' ' ' ALA . 1.4 p -80.55 108.75 14.26 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.305 0 CA-C-N 117.333 0.567 . . . . 0.0 111.107 -179.123 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 40' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -127.28 110.89 13.3 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 115.846 -0.616 . . . . 0.0 109.816 179.325 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 41' ' ' GLY . . . . . 0.485 ' H ' ' CG2' ' X' ' 54' ' ' VAL . . . -141.37 -157.36 7.14 Favored Glycine 0 CA--C 1.533 1.174 0 C-N-CA 120.764 -0.731 . . . . 0.0 111.927 -179.485 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 42' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -75.12 133.05 41.61 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 120.877 0.37 . . . . 0.0 110.254 -179.777 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 43' ' ' TRP . . . . . . . . . . . . . 82.0 m95 -98.02 161.5 13.69 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.734 0.778 . . . . 0.0 112.078 -178.75 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 44' ' ' THR . . . . . 0.499 ' CG2' ' OG1' ' X' ' 53' ' ' THR . 2.5 t -157.07 169.1 25.58 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 114.348 -1.297 . . . . 0.0 108.818 179.381 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 45' ' ' TYR . . . . . 0.627 ' CD1' ' CE1' ' X' ' 52' ' ' PHE . 7.0 t80 -173.38 135.14 0.54 Allowed 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 119.801 -0.76 . . . . 0.0 111.7 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 46' ' ' ASP . . . . . 0.401 ' N ' ' CD1' ' X' ' 45' ' ' TYR . 8.5 t0 -123.56 112.42 17.43 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 115.269 -0.878 . . . . 0.0 108.648 177.955 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 47' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -66.51 -14.65 62.57 Favored 'General case' 0 C--N 1.334 -0.101 0 CA-C-O 120.825 0.345 . . . . 0.0 110.714 -179.547 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.82 -13.19 59.59 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.149 -179.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 49' ' ' THR . . . . . . . . . . . . . 3.0 p -129.03 4.29 5.31 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 112.138 0.421 . . . . 0.0 112.138 -178.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 50' ' ' LYS . . . . . 0.438 ' NZ ' ' SD ' ' X' ' 1' ' ' MET . 11.3 mmpt? 44.9 56.0 5.65 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 119.76 -0.776 . . . . 0.0 110.654 -179.694 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 51' ' ' THR . . . . . . . . . . . . . 36.6 m -149.91 130.0 13.55 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 112.519 0.563 . . . . 0.0 112.519 -179.015 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 52' ' ' PHE . . . . . 0.627 ' CE1' ' CD1' ' X' ' 45' ' ' TYR . 14.0 m-85 -110.89 154.3 24.25 Favored 'General case' 0 C--N 1.346 0.442 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 178.236 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 53' ' ' THR . . . . . 0.499 ' OG1' ' CG2' ' X' ' 44' ' ' THR . 47.5 p -150.95 131.14 13.54 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 120.333 -0.547 . . . . 0.0 110.472 179.151 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 54' ' ' VAL . . . . . 0.498 ' O ' ' ND2' ' X' ' 8' ' ' ASN . 10.8 p -113.48 124.31 69.99 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 179.176 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 55' ' ' THR . . . . . 0.532 ' O ' HG23 ' X' ' 55' ' ' THR . 4.7 t -124.82 120.99 33.28 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 116.4 -0.363 . . . . 0.0 111.445 -178.594 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 56' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 . . . . . 0 C--O 1.22 -0.459 0 CA-C-O 117.917 -1.04 . . . . 0.0 110.208 179.389 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' X' X ' 1' ' ' MET . . . . . 0.601 ' SD ' ' NZ ' ' X' ' 50' ' ' LYS . 0.2 OUTLIER . . . . . 0 N--CA 1.494 1.761 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 2' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 -127.7 138.34 52.76 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 120.998 0.427 . . . . 0.0 111.177 -179.491 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 3' ' ' TYR . . . . . 0.47 ' OH ' ' SD ' ' X' ' 1' ' ' MET . 64.5 m-85 -115.99 141.22 48.41 Favored 'General case' 0 CA--C 1.517 -0.308 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 178.733 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 4' ' ' LYS . . . . . . . . . . . . . 49.8 tttp -119.47 127.28 52.92 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 120.767 0.317 . . . . 0.0 110.34 -179.831 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 5' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -103.32 130.01 50.49 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.109 179.809 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 6' ' ' ILE . . . . . . . . . . . . . 32.6 mm -101.17 127.3 54.55 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.485 0 N-CA-C 109.349 -0.612 . . . . 0.0 109.349 178.07 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 7' ' ' LEU . . . . . 0.493 HD23 HD22 ' X' ' 12' ' ' LEU . 6.3 mp -93.45 112.11 23.93 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.502 -178.841 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 8' ' ' ASN . . . . . 0.558 ' N ' ' OD1' ' X' ' 8' ' ' ASN . 1.9 p-10 -134.59 87.61 2.37 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 178.237 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 9' ' ' GLY . . . . . 0.599 ' H ' ' NZ ' ' X' ' 13' ' ' LYS . . . -125.76 -157.4 9.6 Favored Glycine 0 C--N 1.336 0.543 0 N-CA-C 111.404 -0.678 . . . . 0.0 111.404 -178.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 10' ' ' LYS . . . . . . . . . . . . . 70.8 mttt -79.97 -49.18 12.21 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 121.059 -0.256 . . . . 0.0 111.543 -179.248 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 11' ' ' THR . . . . . . . . . . . . . 42.5 p -130.2 18.46 5.44 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -179.031 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 12' ' ' LEU . . . . . 0.794 ' H ' ' HZ1' ' X' ' 13' ' ' LYS . 0.4 OUTLIER -138.41 106.34 5.68 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 120.803 0.335 . . . . 0.0 110.905 -179.699 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' X' X ' 13' ' ' LYS . . . . . 0.794 ' HZ1' ' H ' ' X' ' 12' ' ' LEU . 0.2 OUTLIER -130.78 138.94 50.16 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.273 179.509 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' X' X ' 14' ' ' GLY . . . . . 0.427 ' O ' ' OE2' ' X' ' 15' ' ' GLU . . . 173.87 -155.4 21.79 Favored Glycine 0 CA--C 1.533 1.183 0 N-CA-C 111.158 -0.777 . . . . 0.0 111.158 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 15' ' ' GLU . . . . . 0.427 ' OE2' ' O ' ' X' ' 14' ' ' GLY . 6.6 mm-40 -134.11 151.98 51.63 Favored 'General case' 0 N--CA 1.465 0.291 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 179.609 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -147.75 141.67 25.85 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 179.142 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 17' ' ' THR . . . . . 0.451 HG23 ' O ' ' X' ' 3' ' ' TYR . 2.6 m -144.4 154.55 43.1 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 121.19 0.519 . . . . 0.0 110.978 179.651 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 18' ' ' THR . . . . . 0.52 HG22 ' CZ ' ' X' ' 30' ' ' PHE . 14.6 t -155.45 153.58 30.55 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.411 -179.845 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 19' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -103.65 105.61 15.89 Favored 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 179.791 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 20' ' ' ALA . . . . . . . . . . . . . . . -126.98 160.45 31.03 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.798 -179.678 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 21' ' ' VAL . . . . . 0.466 ' H ' HG12 ' X' ' 21' ' ' VAL . 1.0 OUTLIER -80.77 -41.4 19.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 N-CA-C 109.29 -0.634 . . . . 0.0 109.29 179.277 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' X' X ' 22' ' ' ASP . . . . . 0.42 ' OD1' ' N ' ' X' ' 22' ' ' ASP . 32.1 p-10 -127.99 161.47 29.08 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.573 -179.774 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.2 -35.19 63.93 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.028 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.63 -37.65 76.37 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.91 -178.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 25' ' ' THR . . . . . 0.402 ' CG2' ' OD1' ' X' ' 22' ' ' ASP . 1.5 t -75.23 -40.19 59.25 Favored 'General case' 0 C--N 1.345 0.376 0 CA-C-N 118.129 0.422 . . . . 0.0 111.239 -179.337 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.93 -35.58 78.67 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.849 0.356 . . . . 0.0 111.162 -179.448 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 27' ' ' GLU . . . . . 0.435 ' O ' ' CB ' ' X' ' 31' ' ' LYS . 1.6 pt-20 -59.59 -30.46 68.69 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.237 -179.235 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 28' ' ' LYS . . . . . . . . . . . . . 81.7 mttt -58.07 -48.83 78.93 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.307 -0.557 . . . . 0.0 110.326 -178.425 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 29' ' ' VAL . . . . . 0.43 ' O ' ' CB ' ' X' ' 33' ' ' TYR . 12.4 t -72.55 -51.72 27.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-O 121.189 0.518 . . . . 0.0 110.795 179.24 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 30' ' ' PHE . . . . . 0.52 ' CZ ' HG22 ' X' ' 18' ' ' THR . 4.6 m-30 -61.48 -43.18 99.33 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.828 -178.672 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 31' ' ' LYS . . . . . 0.435 ' CB ' ' O ' ' X' ' 27' ' ' GLU . 14.9 ttmt -66.65 -46.98 73.99 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.218 -0.593 . . . . 0.0 110.575 -179.892 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 32' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -73.49 -32.86 64.51 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.118 -179.862 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 33' ' ' TYR . . . . . 0.43 ' CB ' ' O ' ' X' ' 29' ' ' VAL . 58.1 t80 -60.66 -46.09 91.63 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.141 -178.922 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 34' ' ' ALA . . . . . 0.584 ' HB1' ' O ' ' X' ' 39' ' ' VAL . . . -60.17 -36.42 77.55 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.649 -0.421 . . . . 0.0 110.171 -179.733 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 35' ' ' ASN . . . . . . . . . . . . . 5.7 t30 -71.18 -44.49 65.35 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 179.416 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 36' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -67.39 -32.77 73.9 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.827 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 37' ' ' ASN . . . . . 0.563 ' OD1' ' N ' ' X' ' 38' ' ' GLY . 24.5 p30 -79.23 -24.3 43.16 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 120.474 -0.49 . . . . 0.0 111.328 -178.832 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 38' ' ' GLY . . . . . 0.563 ' N ' ' OD1' ' X' ' 37' ' ' ASN . . . 130.87 -44.41 1.21 Allowed Glycine 0 CA--C 1.532 1.134 0 C-N-CA 121.257 -0.497 . . . . 0.0 112.738 178.601 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 39' ' ' VAL . . . . . 0.584 ' O ' ' HB1' ' X' ' 34' ' ' ALA . 1.9 p -81.0 109.08 14.98 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 CA-C-N 117.403 0.601 . . . . 0.0 112.089 -178.114 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 40' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -128.19 111.02 12.98 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.49 178.813 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 41' ' ' GLY . . . . . 0.449 ' H ' ' CG2' ' X' ' 54' ' ' VAL . . . -143.52 -155.24 6.36 Favored Glycine 0 CA--C 1.533 1.202 0 C-N-CA 120.291 -0.957 . . . . 0.0 112.471 -179.298 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 42' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -74.37 141.64 45.13 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 -179.856 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 43' ' ' TRP . . . . . . . . . . . . . 83.6 m95 -104.99 162.37 13.41 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.897 0.856 . . . . 0.0 112.858 -177.829 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 44' ' ' THR . . . . . 0.498 ' CG2' ' OG1' ' X' ' 53' ' ' THR . 2.5 t -157.01 164.21 38.24 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 114.073 -1.421 . . . . 0.0 108.828 179.339 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 45' ' ' TYR . . . . . 0.62 ' CD1' ' CE1' ' X' ' 52' ' ' PHE . 3.0 t80 -175.03 134.53 0.34 Allowed 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 119.701 -0.8 . . . . 0.0 111.666 179.862 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 46' ' ' ASP . . . . . 0.514 ' N ' ' CD1' ' X' ' 45' ' ' TYR . 11.2 t0 -123.74 112.56 17.49 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 115.186 -0.916 . . . . 0.0 108.699 177.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 47' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -65.81 -15.63 63.06 Favored 'General case' 0 C--O 1.231 0.079 0 CA-C-O 120.698 0.285 . . . . 0.0 110.918 -179.674 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.33 -13.67 59.49 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.069 -179.729 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 49' ' ' THR . . . . . . . . . . . . . 2.7 p -128.29 3.14 5.73 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 121.436 -0.106 . . . . 0.0 110.725 -179.657 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 50' ' ' LYS . . . . . 0.601 ' NZ ' ' SD ' ' X' ' 1' ' ' MET . 68.6 mmtt 41.18 56.39 3.07 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 120.839 -0.344 . . . . 0.0 110.632 -179.938 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 51' ' ' THR . . . . . . . . . . . . . 96.8 m -144.16 127.02 16.29 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 120.671 0.272 . . . . 0.0 111.456 -179.409 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 52' ' ' PHE . . . . . 0.62 ' CE1' ' CD1' ' X' ' 45' ' ' TYR . 15.9 m-85 -109.44 153.93 23.34 Favored 'General case' 0 C--N 1.343 0.295 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 179.109 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 53' ' ' THR . . . . . 0.498 ' OG1' ' CG2' ' X' ' 44' ' ' THR . 4.3 p -152.23 129.3 11.09 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 120.493 -0.483 . . . . 0.0 109.989 178.82 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 54' ' ' VAL . . . . . 0.473 ' O ' HG13 ' X' ' 54' ' ' VAL . 14.4 p -112.84 124.2 69.25 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 178.48 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 55' ' ' THR . . . . . 0.431 ' O ' HG23 ' X' ' 55' ' ' THR . 2.0 t -124.55 124.49 42.38 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.651 -178.085 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 56' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 . . . . . 0 C--O 1.221 -0.402 0 CA-C-O 117.968 -1.015 . . . . 0.0 110.09 179.465 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' X' X ' 1' ' ' MET . . . . . 0.54 ' SD ' ' NZ ' ' X' ' 50' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.706 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 2' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -127.91 142.27 51.31 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.879 0.371 . . . . 0.0 110.756 -179.827 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 3' ' ' TYR . . . . . 0.537 ' O ' HG23 ' X' ' 17' ' ' THR . 92.0 m-85 -115.81 148.44 39.89 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.9 -0.591 . . . . 0.0 109.627 179.379 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 4' ' ' LYS . . . . . . . . . . . . . 45.5 tttp -119.27 127.81 53.58 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 120.927 0.394 . . . . 0.0 110.259 179.842 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 5' ' ' LEU . . . . . 0.706 HD13 ' C ' ' X' ' 5' ' ' LEU . 1.1 tm? -109.72 127.83 54.86 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.403 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 6' ' ' ILE . . . . . 0.518 ' N ' HD22 ' X' ' 5' ' ' LEU . 26.8 mm -98.91 132.34 44.41 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.349 0 CA-C-O 120.901 0.381 . . . . 0.0 110.15 -179.361 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 7' ' ' LEU . . . . . 0.435 HD21 HD22 ' X' ' 37' ' ' ASN . 6.3 mp -92.42 110.75 22.16 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.649 -179.131 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 8' ' ' ASN . . . . . 0.469 ' N ' ' OD1' ' X' ' 8' ' ' ASN . 6.3 p-10 -134.57 87.68 2.37 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 178.034 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 9' ' ' GLY . . . . . 0.821 ' H ' ' HZ1' ' X' ' 13' ' ' LYS . . . -123.89 -143.5 6.26 Favored Glycine 0 N--CA 1.464 0.552 0 N-CA-C 111.662 -0.575 . . . . 0.0 111.662 -179.158 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 10' ' ' LYS . . . . . . . . . . . . . 74.1 mttt -87.98 -53.17 4.87 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 111.818 0.303 . . . . 0.0 111.818 -179.274 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 11' ' ' THR . . . . . . . . . . . . . 41.4 p -130.29 21.83 5.23 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 -178.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 12' ' ' LEU . . . . . 0.777 ' C ' ' HZ2' ' X' ' 13' ' ' LYS . 0.6 OUTLIER -138.56 116.98 12.0 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 120.707 0.289 . . . . 0.0 110.725 -179.95 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' X' X ' 13' ' ' LYS . . . . . 0.821 ' HZ1' ' H ' ' X' ' 9' ' ' GLY . 0.3 OUTLIER -138.88 139.72 38.17 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.009 0.433 . . . . 0.0 110.749 179.889 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' X' X ' 14' ' ' GLY . . . . . 0.439 ' O ' ' OE1' ' X' ' 15' ' ' GLU . . . 174.17 -155.24 21.15 Favored Glycine 0 CA--C 1.533 1.17 0 N-CA-C 110.624 -0.991 . . . . 0.0 110.624 -179.913 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 15' ' ' GLU . . . . . 0.439 ' OE1' ' O ' ' X' ' 14' ' ' GLY . 5.2 mm-40 -133.83 150.87 51.42 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.863 0.332 . . . . 0.0 110.166 179.684 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 2.8 m -147.9 129.22 14.77 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 120.776 -0.37 . . . . 0.0 110.159 179.006 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 17' ' ' THR . . . . . 0.537 HG23 ' O ' ' X' ' 3' ' ' TYR . 2.5 m -130.69 156.79 44.33 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 120.989 0.423 . . . . 0.0 110.544 179.895 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 18' ' ' THR . . . . . . . . . . . . . 7.6 t -148.91 152.88 37.17 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 115.881 -0.599 . . . . 0.0 109.545 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 19' ' ' GLU . . . . . 0.422 ' OE2' ' O ' ' X' ' 1' ' ' MET . 1.1 tm-20 -104.21 105.55 15.73 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 -179.679 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 20' ' ' ALA . . . . . 0.419 ' O ' ' O ' ' X' ' 1' ' ' MET . . . -136.66 163.12 31.32 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.69 -179.579 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 21' ' ' VAL . . . . . 0.453 ' H ' HG12 ' X' ' 21' ' ' VAL . 1.1 p -88.56 -40.78 13.69 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.595 179.26 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 22' ' ' ASP . . . . . 0.426 ' OD1' ' N ' ' X' ' 23' ' ' ALA . 46.5 t0 -103.61 154.41 19.53 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.376 -179.247 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 23' ' ' ALA . . . . . 0.426 ' N ' ' OD1' ' X' ' 22' ' ' ASP . . . -75.08 -43.35 53.61 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.87 179.599 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.34 -39.79 94.59 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.595 -179.148 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 25' ' ' THR . . . . . . . . . . . . . 1.2 t -64.11 -34.2 77.51 Favored 'General case' 0 C--N 1.345 0.405 0 C-N-CA 120.665 -0.414 . . . . 0.0 110.572 -179.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.43 -35.88 78.26 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.877 0.37 . . . . 0.0 110.777 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 27' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -61.58 -28.02 69.05 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.859 -179.6 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 28' ' ' LYS . . . . . . . . . . . . . 83.8 mttt -56.8 -44.27 81.77 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.535 -0.466 . . . . 0.0 110.003 -179.025 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 29' ' ' VAL . . . . . 0.429 ' O ' ' CB ' ' X' ' 33' ' ' TYR . 11.5 t -70.15 -50.92 43.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.647 179.289 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 30' ' ' PHE . . . . . . . . . . . . . 55.0 m-85 -61.8 -43.53 98.67 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.111 -0.495 . . . . 0.0 112.009 -179.019 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 31' ' ' LYS . . . . . . . . . . . . . 67.5 mttt -70.47 -40.94 73.37 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 120.215 -0.594 . . . . 0.0 110.386 -179.627 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 32' ' ' GLN . . . . . . . . . . . . . 3.6 tp-100 -73.17 -33.55 65.52 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 179.168 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 33' ' ' TYR . . . . . 0.429 ' CB ' ' O ' ' X' ' 29' ' ' VAL . 29.2 t80 -66.76 -36.83 83.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.877 -179.848 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 34' ' ' ALA . . . . . 0.509 ' HB1' ' O ' ' X' ' 39' ' ' VAL . . . -59.38 -41.83 90.28 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.492 -179.188 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 35' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -66.67 -37.68 85.27 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 179.209 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 36' ' ' ASP . . . . . 0.491 ' OD1' ' N ' ' X' ' 36' ' ' ASP . 0.9 OUTLIER -67.71 -33.15 74.31 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.404 -0.816 . . . . 0.0 111.938 -179.908 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' X' X ' 37' ' ' ASN . . . . . 0.605 HD21 ' CG1' ' X' ' 39' ' ' VAL . 14.8 p-10 -90.59 -24.57 20.52 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 120.766 -0.374 . . . . 0.0 111.883 -178.301 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 38' ' ' GLY . . . . . 0.535 ' N ' ' OD1' ' X' ' 37' ' ' ASN . . . 118.92 -39.2 2.61 Favored Glycine 0 CA--C 1.533 1.2 0 C-N-CA 121.228 -0.51 . . . . 0.0 113.806 177.752 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 39' ' ' VAL . . . . . 0.605 ' CG1' HD21 ' X' ' 37' ' ' ASN . 1.5 p -80.24 108.29 13.51 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 CA-C-N 117.974 0.887 . . . . 0.0 111.549 -178.042 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 40' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -127.78 111.94 14.21 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 115.762 -0.654 . . . . 0.0 109.861 179.143 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 41' ' ' GLY . . . . . 0.524 ' H ' ' CG2' ' X' ' 54' ' ' VAL . . . -141.82 -154.96 6.3 Favored Glycine 0 CA--C 1.534 1.223 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.149 -179.464 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 42' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -74.98 137.34 41.5 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 110.092 -0.336 . . . . 0.0 110.092 -179.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 43' ' ' TRP . . . . . . . . . . . . . 82.1 m95 -102.97 161.88 13.39 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.767 0.794 . . . . 0.0 112.611 -178.45 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 44' ' ' THR . . . . . 0.481 ' CG2' ' OG1' ' X' ' 53' ' ' THR . 11.3 t -157.01 169.04 25.74 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.181 -1.372 . . . . 0.0 108.368 179.251 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 45' ' ' TYR . . . . . 0.612 ' CD1' ' CE1' ' X' ' 52' ' ' PHE . 3.0 t80 -174.43 135.27 0.42 Allowed 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 119.597 -0.841 . . . . 0.0 111.819 -179.951 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 46' ' ' ASP . . . . . 0.517 ' N ' ' CD1' ' X' ' 45' ' ' TYR . 14.8 t0 -123.68 112.5 17.46 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 115.206 -0.907 . . . . 0.0 108.804 177.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 47' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -66.56 -14.94 63.01 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-O 120.775 0.321 . . . . 0.0 110.831 -179.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.34 -14.53 58.92 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.082 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 49' ' ' THR . . . . . . . . . . . . . 2.7 p -128.27 3.33 5.74 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 121.475 -0.09 . . . . 0.0 110.888 -179.737 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 50' ' ' LYS . . . . . 0.54 ' NZ ' ' SD ' ' X' ' 1' ' ' MET . 68.7 mmtt 41.63 56.7 3.25 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 120.799 -0.36 . . . . 0.0 110.546 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 51' ' ' THR . . . . . . . . . . . . . 86.3 m -146.24 127.84 15.15 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 120.775 0.322 . . . . 0.0 111.828 -179.303 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 52' ' ' PHE . . . . . 0.612 ' CE1' ' CD1' ' X' ' 45' ' ' TYR . 11.0 m-85 -108.2 155.29 20.62 Favored 'General case' 0 C--N 1.343 0.301 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 178.725 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 53' ' ' THR . . . . . 0.481 ' OG1' ' CG2' ' X' ' 44' ' ' THR . 58.8 p -150.97 130.54 13.02 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 120.513 -0.475 . . . . 0.0 110.396 179.277 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 54' ' ' VAL . . . . . 0.524 ' CG2' ' H ' ' X' ' 41' ' ' GLY . 11.4 p -113.58 123.89 69.68 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.408 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 179.243 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 55' ' ' THR . . . . . 0.52 ' O ' HG23 ' X' ' 55' ' ' THR . 4.2 t -125.31 120.39 31.03 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.403 -178.715 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 56' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 . . . . . 0 C--O 1.219 -0.517 0 CA-C-O 118.117 -0.944 . . . . 0.0 110.094 179.567 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' X' X ' 1' ' ' MET . . . . . 0.434 ' O ' ' OE2' ' X' ' 19' ' ' GLU . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.609 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 2' ' ' GLN . . . . . . . . . . . . . 80.0 mt-30 -126.85 139.19 53.27 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 120.961 0.41 . . . . 0.0 111.312 -179.497 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 3' ' ' TYR . . . . . 0.636 ' CD1' ' N ' ' X' ' 3' ' ' TYR . 0.1 OUTLIER -119.87 168.74 10.81 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 178.866 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' X' X ' 4' ' ' LYS . . . . . . . . . . . . . 28.7 tttm -135.86 128.78 31.29 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 121.062 -0.255 . . . . 0.0 110.566 -179.829 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 5' ' ' LEU . . . . . 0.573 HD22 ' N ' ' X' ' 6' ' ' ILE . 1.7 tm? -105.79 126.26 51.96 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 179.633 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 6' ' ' ILE . . . . . 0.573 ' N ' HD22 ' X' ' 5' ' ' LEU . 32.9 mm -98.14 132.54 42.91 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.452 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 179.393 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 7' ' ' LEU . . . . . 0.502 HD23 HD22 ' X' ' 12' ' ' LEU . 5.7 mp -92.21 115.25 27.92 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.652 -179.536 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 8' ' ' ASN . . . . . . . . . . . . . 35.1 t30 -134.55 87.52 2.36 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 177.863 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 9' ' ' GLY . . . . . 0.529 ' H ' ' HD3' ' X' ' 13' ' ' LYS . . . -126.85 -163.0 11.37 Favored Glycine 0 C--N 1.336 0.541 0 N-CA-C 111.291 -0.724 . . . . 0.0 111.291 -179.096 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 10' ' ' LYS . . . . . . . . . . . . . 40.5 mtmt -80.55 -43.02 21.34 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.938 -0.305 . . . . 0.0 110.937 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 11' ' ' THR . . . . . . . . . . . . . 42.3 p -130.54 15.78 5.43 Favored 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 112.3 0.482 . . . . 0.0 112.3 -179.195 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 12' ' ' LEU . . . . . 0.664 ' N ' ' HZ2' ' X' ' 13' ' ' LYS . 0.3 OUTLIER -138.52 100.44 4.09 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 120.842 -0.343 . . . . 0.0 111.642 -179.526 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' X' X ' 13' ' ' LYS . . . . . 0.664 ' HZ2' ' N ' ' X' ' 12' ' ' LEU . 0.0 OUTLIER -122.44 137.77 54.76 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 178.829 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' X' X ' 14' ' ' GLY . . . . . . . . . . . . . . . 173.17 -154.6 20.85 Favored Glycine 0 CA--C 1.533 1.184 0 N-CA-C 111.082 -0.807 . . . . 0.0 111.082 -179.73 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 15' ' ' GLU . . . . . . . . . . . . . 56.8 mm-40 -131.8 152.74 50.76 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.595 0.236 . . . . 0.0 110.469 179.613 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -148.23 154.85 40.62 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 120.969 0.414 . . . . 0.0 110.441 179.716 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 17' ' ' THR . . . . . 0.594 HG23 ' O ' ' X' ' 3' ' ' TYR . 2.0 m -145.96 158.93 43.86 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.737 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 18' ' ' THR . . . . . . . . . . . . . 4.4 t -153.08 151.2 29.94 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-N 116.203 -0.453 . . . . 0.0 109.885 179.069 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 19' ' ' GLU . . . . . 0.434 ' OE2' ' O ' ' X' ' 1' ' ' MET . 0.8 OUTLIER -106.55 110.81 23.12 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.089 179.769 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' X' X ' 20' ' ' ALA . . . . . . . . . . . . . . . -147.57 162.12 39.75 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.055 0.455 . . . . 0.0 110.597 179.766 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 21' ' ' VAL . . . . . 0.448 HG12 ' H ' ' X' ' 21' ' ' VAL . 1.1 p -87.0 -41.38 14.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.717 179.561 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 22' ' ' ASP . . . . . . . . . . . . . 68.6 m-20 -103.86 151.82 22.66 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.482 -179.033 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.43 -37.46 63.31 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.298 -0.864 . . . . 0.0 110.872 179.735 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 24' ' ' ALA . . . . . . . . . . . . . . . -70.49 -38.23 74.33 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.332 -179.197 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 25' ' ' THR . . . . . . . . . . . . . 1.1 t -67.29 -29.82 69.52 Favored 'General case' 0 C--N 1.345 0.408 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.621 -179.835 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.55 -35.77 79.69 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.495 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 27' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -58.31 -30.4 66.63 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.579 -179.771 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 28' ' ' LYS . . . . . . . . . . . . . 41.7 mtmt -57.34 -39.52 76.09 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.472 -0.491 . . . . 0.0 110.181 -178.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 29' ' ' VAL . . . . . 0.415 ' O ' ' CB ' ' X' ' 33' ' ' TYR . 13.0 t -70.02 -51.47 39.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.543 179.33 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 30' ' ' PHE . . . . . . . . . . . . . 40.8 m-85 -64.59 -42.97 95.25 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.859 -179.412 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 31' ' ' LYS . . . . . . . . . . . . . 2.8 tppt? -61.46 -49.2 77.75 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 120.282 -0.567 . . . . 0.0 110.78 -179.478 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 32' ' ' GLN . . . . . . . . . . . . . 89.6 mt-30 -73.08 -38.36 66.44 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.838 -179.746 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 33' ' ' TYR . . . . . 0.528 ' CZ ' ' OD1' ' X' ' 37' ' ' ASN . 69.8 t80 -61.8 -37.47 84.51 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.645 -179.797 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 34' ' ' ALA . . . . . 0.474 ' HB1' ' O ' ' X' ' 39' ' ' VAL . . . -59.27 -38.06 79.17 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.39 -179.325 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 35' ' ' ASN . . . . . . . . . . . . . 10.0 m-20 -61.18 -48.17 82.78 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 179.504 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 36' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -66.81 -24.7 66.2 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.02 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 37' ' ' ASN . . . . . 0.528 ' OD1' ' CZ ' ' X' ' 33' ' ' TYR . 1.0 OUTLIER -87.27 -26.08 23.63 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 116.471 -0.332 . . . . 0.0 110.996 -178.943 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' X' X ' 38' ' ' GLY . . . . . . . . . . . . . . . 106.08 -36.91 4.1 Favored Glycine 0 CA--C 1.53 1.019 0 C-N-CA 121.359 -0.448 . . . . 0.0 112.563 178.626 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 39' ' ' VAL . . . . . 0.474 ' O ' ' HB1' ' X' ' 34' ' ' ALA . 3.1 p -79.96 107.74 12.68 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.39 0 CA-C-N 117.575 0.687 . . . . 0.0 110.983 -179.096 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 40' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -128.12 110.83 12.83 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.888 179.358 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 41' ' ' GLY . . . . . 0.513 ' H ' ' CG2' ' X' ' 54' ' ' VAL . . . -141.86 -155.72 6.56 Favored Glycine 0 CA--C 1.531 1.064 0 C-N-CA 120.683 -0.77 . . . . 0.0 111.943 -179.69 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 42' ' ' GLU . . . . . . . . . . . . . 10.9 mt-10 -74.99 133.62 41.65 Favored 'General case' 0 N--CA 1.446 -0.631 0 N-CA-C 110.129 -0.323 . . . . 0.0 110.129 -179.803 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 43' ' ' TRP . . . . . . . . . . . . . 90.6 m95 -99.19 162.36 13.1 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.476 0.655 . . . . 0.0 111.892 -178.541 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 44' ' ' THR . . . . . 0.507 ' CG2' ' OG1' ' X' ' 53' ' ' THR . 2.5 t -156.9 167.11 31.46 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 114.845 -1.071 . . . . 0.0 109.492 179.783 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 45' ' ' TYR . . . . . 0.63 ' CD1' ' CZ ' ' X' ' 52' ' ' PHE . 64.7 t80 -166.52 136.7 3.24 Favored 'General case' 0 CA--C 1.519 -0.241 0 C-N-CA 120.116 -0.634 . . . . 0.0 111.958 179.739 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 46' ' ' ASP . . . . . . . . . . . . . 18.8 t0 -123.44 111.79 16.76 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 177.523 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 47' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -67.11 -15.74 63.9 Favored 'General case' 0 C--O 1.231 0.095 0 CA-C-O 120.882 0.372 . . . . 0.0 110.751 -179.708 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.35 -18.09 53.17 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.115 -179.698 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 49' ' ' THR . . . . . . . . . . . . . 2.6 p -128.2 2.74 5.79 Favored 'General case' 0 N--CA 1.469 0.521 0 N-CA-C 110.626 -0.139 . . . . 0.0 110.626 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 50' ' ' LYS . . . . . . . . . . . . . 65.7 mmtt 39.64 55.69 2.39 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-O 120.583 0.23 . . . . 0.0 110.712 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 51' ' ' THR . . . . . . . . . . . . . 99.7 m -138.31 129.65 27.48 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.018 -179.6 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 52' ' ' PHE . . . . . 0.63 ' CZ ' ' CD1' ' X' ' 45' ' ' TYR . 87.3 m-85 -107.29 154.26 21.52 Favored 'General case' 0 C--N 1.342 0.281 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 179.46 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 53' ' ' THR . . . . . 0.507 ' OG1' ' CG2' ' X' ' 44' ' ' THR . 24.2 p -151.9 130.44 12.23 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 120.599 -0.44 . . . . 0.0 110.253 178.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 54' ' ' VAL . . . . . 0.513 ' CG2' ' H ' ' X' ' 41' ' ' GLY . 10.6 p -113.42 123.7 69.33 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 178.871 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 55' ' ' THR . . . . . 0.538 ' O ' HG23 ' X' ' 55' ' ' THR . 4.8 t -125.35 120.7 31.84 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.511 -178.425 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 56' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 . . . . . 0 C--O 1.22 -0.461 0 CA-C-O 118.073 -0.965 . . . . 0.0 110.136 179.252 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' X' X ' 1' ' ' MET . . . . . 0.596 ' SD ' ' CZ ' ' X' ' 3' ' ' TYR . 0.7 OUTLIER . . . . . 0 N--CA 1.493 1.685 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 2' ' ' GLN . . . . . . . . . . . . . 15.5 mm-40 -113.33 134.13 54.78 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.049 0.452 . . . . 0.0 110.92 -179.335 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 3' ' ' TYR . . . . . 0.596 ' CZ ' ' SD ' ' X' ' 1' ' ' MET . 38.1 m-85 -125.61 137.01 53.87 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.771 -0.65 . . . . 0.0 109.412 179.17 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 4' ' ' LYS . . . . . . . . . . . . . 44.8 tttp -119.97 128.06 53.22 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 120.923 0.392 . . . . 0.0 110.703 -179.821 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 5' ' ' LEU . . . . . 0.71 HD13 ' C ' ' X' ' 5' ' ' LEU . 1.0 OUTLIER -109.29 127.94 54.69 Favored 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 179.435 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' X' X ' 6' ' ' ILE . . . . . 0.537 ' N ' HD22 ' X' ' 5' ' ' LEU . 27.0 mm -98.99 132.35 44.51 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 CA-C-O 120.948 0.404 . . . . 0.0 110.176 -179.386 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 7' ' ' LEU . . . . . 0.406 ' HB2' ' H ' ' X' ' 14' ' ' GLY . 6.0 mp -92.66 110.24 21.66 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.664 -179.19 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 8' ' ' ASN . . . . . . . . . . . . . 12.7 t30 -132.91 87.52 2.41 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 178.298 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 9' ' ' GLY . . . . . 0.837 ' C ' ' HZ1' ' X' ' 13' ' ' LYS . . . -122.79 -147.35 7.39 Favored Glycine 0 N--CA 1.464 0.537 0 N-CA-C 111.462 -0.655 . . . . 0.0 111.462 -179.203 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 10' ' ' LYS . . . . . . . . . . . . . 57.1 mttt -79.17 -50.15 11.43 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 120.989 -0.284 . . . . 0.0 111.46 -179.486 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 11' ' ' THR . . . . . 0.436 ' C ' ' HZ3' ' X' ' 13' ' ' LYS . 41.5 p -130.35 -19.62 3.09 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 -179.427 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 12' ' ' LEU . . . . . 0.749 ' N ' ' HZ3' ' X' ' 13' ' ' LYS . 0.5 OUTLIER -92.15 119.51 31.87 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-O 120.648 0.261 . . . . 0.0 111.156 -178.943 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' X' X ' 13' ' ' LYS . . . . . 0.837 ' HZ1' ' C ' ' X' ' 9' ' ' GLY . 0.1 OUTLIER -140.18 139.24 35.66 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 120.907 0.384 . . . . 0.0 110.255 179.449 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' X' X ' 14' ' ' GLY . . . . . 0.438 ' O ' ' OE1' ' X' ' 15' ' ' GLU . . . 173.79 -155.01 21.13 Favored Glycine 0 CA--C 1.533 1.216 0 N-CA-C 110.671 -0.972 . . . . 0.0 110.671 -179.933 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 15' ' ' GLU . . . . . 0.438 ' OE1' ' O ' ' X' ' 14' ' ' GLY . 5.0 mm-40 -133.82 151.09 51.46 Favored 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 110.098 -0.334 . . . . 0.0 110.098 179.622 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 2.8 m -147.86 129.18 14.78 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.052 178.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 17' ' ' THR . . . . . 0.533 HG23 ' O ' ' X' ' 3' ' ' TYR . 2.4 m -129.47 157.05 43.08 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-O 121.003 0.43 . . . . 0.0 110.551 179.936 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 18' ' ' THR . . . . . . . . . . . . . 7.2 t -150.55 152.69 34.52 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.601 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 19' ' ' GLU . . . . . 0.443 ' OE2' ' O ' ' X' ' 1' ' ' MET . 1.2 tm-20 -104.42 105.61 15.8 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.846 -0.427 . . . . 0.0 109.846 -179.626 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 20' ' ' ALA . . . . . . . . . . . . . . . -136.39 163.29 30.79 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.728 -179.668 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 21' ' ' VAL . . . . . 0.447 ' H ' HG12 ' X' ' 21' ' ' VAL . 1.1 p -89.04 -41.23 13.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.358 179.356 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 22' ' ' ASP . . . . . . . . . . . . . 46.5 t0 -102.27 152.71 20.74 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.335 -179.267 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 23' ' ' ALA . . . . . . . . . . . . . . . -75.14 -39.68 60.28 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.73 179.645 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 24' ' ' ALA . . . . . . . . . . . . . . . -67.51 -39.84 85.12 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.332 -179.087 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 25' ' ' THR . . . . . . . . . . . . . 1.2 t -64.24 -33.33 75.57 Favored 'General case' 0 C--N 1.345 0.409 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.62 -179.73 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.12 -35.99 79.01 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.973 0.416 . . . . 0.0 110.681 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 27' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -62.88 -28.43 70.03 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.594 -179.607 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 28' ' ' LYS . . . . . . . . . . . . . 83.5 mttt -57.17 -43.77 82.9 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 120.588 -0.445 . . . . 0.0 109.805 -179.163 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 29' ' ' VAL . . . . . 0.451 ' O ' ' N ' ' X' ' 33' ' ' TYR . 11.9 t -70.24 -50.88 43.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.588 179.296 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 30' ' ' PHE . . . . . . . . . . . . . 56.0 m-85 -61.76 -43.93 97.88 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.181 -0.463 . . . . 0.0 112.011 -179.236 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 31' ' ' LYS . . . . . . . . . . . . . 69.7 mttt -69.26 -41.76 76.48 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 120.173 -0.611 . . . . 0.0 110.281 -179.794 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 32' ' ' GLN . . . . . . . . . . . . . 59.6 tp60 -73.2 -33.14 65.22 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.038 0.447 . . . . 0.0 110.039 179.226 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 33' ' ' TYR . . . . . 0.451 ' N ' ' O ' ' X' ' 29' ' ' VAL . 69.3 t80 -71.23 -42.18 69.2 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.12 -179.794 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 34' ' ' ALA . . . . . 0.408 ' HB1' ' O ' ' X' ' 39' ' ' VAL . . . -58.73 -38.08 77.58 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 120.839 -0.344 . . . . 0.0 110.4 -179.09 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 35' ' ' ASN . . . . . . . . . . . . . 40.3 t-20 -63.19 -45.54 91.27 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 179.042 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 36' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -66.81 -25.02 66.25 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.622 179.415 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 37' ' ' ASN . . . . . 0.407 ' ND2' ' CE2' ' X' ' 33' ' ' TYR . 0.9 OUTLIER -85.09 -26.53 26.89 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.983 -178.839 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' X' X ' 38' ' ' GLY . . . . . . . . . . . . . . . 113.19 -37.91 3.43 Favored Glycine 0 CA--C 1.531 1.052 0 C-N-CA 121.541 -0.362 . . . . 0.0 112.973 178.354 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 39' ' ' VAL . . . . . 0.408 ' O ' ' HB1' ' X' ' 34' ' ' ALA . 1.5 p -80.63 108.64 14.22 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.394 0 CA-C-N 117.73 0.765 . . . . 0.0 111.161 -178.551 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 40' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -127.42 110.85 13.2 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.677 179.172 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 41' ' ' GLY . . . . . 0.502 ' H ' ' CG2' ' X' ' 54' ' ' VAL . . . -142.26 -155.17 6.35 Favored Glycine 0 CA--C 1.532 1.11 0 C-N-CA 120.606 -0.807 . . . . 0.0 111.981 -179.407 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 42' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -75.12 132.06 40.95 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-O 120.885 0.374 . . . . 0.0 110.152 -179.699 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 43' ' ' TRP . . . . . . . . . . . . . 81.5 m95 -97.92 161.41 13.75 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.65 0.738 . . . . 0.0 112.05 -178.672 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 44' ' ' THR . . . . . 0.502 ' CG2' ' OG1' ' X' ' 53' ' ' THR . 2.5 t -157.0 169.07 25.66 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 114.509 -1.223 . . . . 0.0 108.885 179.483 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 45' ' ' TYR . . . . . 0.615 ' CD1' ' CE1' ' X' ' 52' ' ' PHE . 2.6 t80 -173.9 135.55 0.5 Allowed 'General case' 0 C--N 1.331 -0.21 0 C-N-CA 119.697 -0.801 . . . . 0.0 111.691 -179.917 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 46' ' ' ASP . . . . . 0.539 ' N ' ' CD1' ' X' ' 45' ' ' TYR . 8.1 t0 -123.84 112.6 17.47 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 115.155 -0.929 . . . . 0.0 108.872 178.067 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 47' ' ' ASP . . . . . 0.422 ' OD1' ' OH ' ' X' ' 45' ' ' TYR . 25.0 t0 -66.47 -15.48 63.38 Favored 'General case' 0 C--O 1.23 0.057 0 CA-C-O 120.728 0.299 . . . . 0.0 110.856 -179.722 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.51 -14.88 58.57 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.069 -179.702 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 49' ' ' THR . . . . . . . . . . . . . 2.7 p -128.28 3.84 5.75 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 121.394 -0.122 . . . . 0.0 110.792 -179.656 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 50' ' ' LYS . . . . . 0.55 ' NZ ' ' SD ' ' X' ' 1' ' ' MET . 64.3 mmtt 40.89 57.34 2.74 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 120.922 -0.311 . . . . 0.0 110.693 -179.885 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 51' ' ' THR . . . . . . . . . . . . . 85.1 m -146.62 127.88 14.81 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 120.725 0.298 . . . . 0.0 111.747 -179.435 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 52' ' ' PHE . . . . . 0.615 ' CE1' ' CD1' ' X' ' 45' ' ' TYR . 10.5 m-85 -107.64 154.11 21.92 Favored 'General case' 0 C--N 1.342 0.261 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 178.749 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 53' ' ' THR . . . . . 0.502 ' OG1' ' CG2' ' X' ' 44' ' ' THR . 36.4 p -150.97 130.36 12.88 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 120.447 -0.501 . . . . 0.0 110.187 179.07 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 54' ' ' VAL . . . . . 0.502 ' CG2' ' H ' ' X' ' 41' ' ' GLY . 14.4 p -113.51 123.92 69.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 179.192 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 55' ' ' THR . . . . . 0.507 ' O ' HG23 ' X' ' 55' ' ' THR . 4.3 t -125.24 121.38 33.91 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.525 -178.599 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 56' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 . . . . . 0 C--O 1.219 -0.533 0 CA-C-O 118.067 -0.968 . . . . 0.0 110.035 179.499 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' X' X ' 1' ' ' MET . . . . . 0.53 ' SD ' ' NZ ' ' X' ' 50' ' ' LYS . 0.4 OUTLIER . . . . . 0 N--CA 1.494 1.771 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 2' ' ' GLN . . . . . . . . . . . . . 83.6 mt-30 -127.14 137.54 52.99 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.004 0.43 . . . . 0.0 111.51 -179.135 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 3' ' ' TYR . . . . . 0.515 ' O ' HG23 ' X' ' 17' ' ' THR . 62.6 m-85 -116.93 139.63 50.42 Favored 'General case' 0 CA--C 1.517 -0.303 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 178.729 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 4' ' ' LYS . . . . . . . . . . . . . 52.3 tttp -120.93 127.83 52.19 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-O 120.911 0.386 . . . . 0.0 110.925 -179.3 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 5' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -105.01 129.0 53.56 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 179.08 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 6' ' ' ILE . . . . . . . . . . . . . 32.1 mm -100.94 129.79 51.31 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.419 0 N-CA-C 109.63 -0.508 . . . . 0.0 109.63 178.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 7' ' ' LEU . . . . . 0.407 ' HB2' ' H ' ' X' ' 14' ' ' GLY . 5.1 mp -93.43 110.04 21.61 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.771 -179.587 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 8' ' ' ASN . . . . . 0.523 ' N ' ' OD1' ' X' ' 8' ' ' ASN . 5.1 p-10 -134.83 87.36 2.33 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 178.039 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 9' ' ' GLY . . . . . 0.86 ' C ' ' HZ1' ' X' ' 13' ' ' LYS . . . -122.24 -145.84 7.13 Favored Glycine 0 N--CA 1.464 0.546 0 N-CA-C 111.527 -0.629 . . . . 0.0 111.527 -179.302 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 10' ' ' LYS . . . . . . . . . . . . . 41.2 mtmt -80.61 -49.49 11.21 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 121.157 -0.217 . . . . 0.0 111.551 -179.381 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 11' ' ' THR . . . . . 0.426 ' C ' ' HZ3' ' X' ' 13' ' ' LYS . 41.6 p -129.97 -19.45 3.24 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -179.34 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 12' ' ' LEU . . . . . 0.766 ' N ' ' HZ3' ' X' ' 13' ' ' LYS . 0.4 OUTLIER -93.12 119.18 32.05 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 120.624 0.249 . . . . 0.0 111.066 -178.954 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' X' X ' 13' ' ' LYS . . . . . 0.86 ' HZ1' ' C ' ' X' ' 9' ' ' GLY . 0.1 OUTLIER -141.52 139.21 33.19 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-O 120.974 0.416 . . . . 0.0 110.351 179.351 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' X' X ' 14' ' ' GLY . . . . . 0.438 ' O ' ' OE1' ' X' ' 15' ' ' GLU . . . 173.62 -155.11 21.52 Favored Glycine 0 CA--C 1.533 1.195 0 N-CA-C 110.771 -0.932 . . . . 0.0 110.771 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 15' ' ' GLU . . . . . 0.438 ' OE1' ' O ' ' X' ' 14' ' ' GLY . 6.6 mm-40 -129.72 154.64 46.97 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.85 0.357 . . . . 0.0 110.218 179.553 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -147.54 145.47 29.09 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.067 179.797 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 17' ' ' THR . . . . . 0.515 HG23 ' O ' ' X' ' 3' ' ' TYR . 1.8 m -146.11 157.25 43.84 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.943 0.401 . . . . 0.0 111.048 179.23 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 18' ' ' THR . . . . . . . . . . . . . 7.4 t -155.24 152.9 29.86 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.102 179.636 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 19' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -104.42 105.91 16.21 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 179.805 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 20' ' ' ALA . . . . . . . . . . . . . . . -130.64 159.01 38.48 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 121.107 0.48 . . . . 0.0 110.793 -179.849 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 21' ' ' VAL . . . . . 0.441 ' H ' HG12 ' X' ' 21' ' ' VAL . 1.0 OUTLIER -82.14 -41.09 17.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.316 179.118 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' X' X ' 22' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -111.56 157.3 20.53 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.131 -179.45 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.88 -42.92 56.93 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.659 -0.701 . . . . 0.0 111.133 179.849 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 24' ' ' ALA . . . . . . . . . . . . . . . -66.34 -41.38 89.66 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.563 -178.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 25' ' ' THR . . . . . . . . . . . . . 1.2 t -59.63 -35.61 74.72 Favored 'General case' 0 C--N 1.345 0.406 0 C-N-CA 120.734 -0.386 . . . . 0.0 110.716 -179.619 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.85 -35.02 77.84 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.924 0.392 . . . . 0.0 110.655 -179.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 27' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -57.25 -29.32 63.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.806 -179.317 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 28' ' ' LYS . . . . . . . . . . . . . 41.8 mtmt -57.34 -43.85 83.77 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.234 -178.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 29' ' ' VAL . . . . . 0.444 ' O ' ' CB ' ' X' ' 33' ' ' TYR . 19.1 t -69.47 -46.35 76.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.174 179.168 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 30' ' ' PHE . . . . . . . . . . . . . 8.4 m-30 -61.52 -43.41 98.91 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.308 -179.621 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 31' ' ' LYS . . . . . . . . . . . . . 2.4 tppt? -63.14 -50.1 71.76 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 120.335 -0.546 . . . . 0.0 110.763 -179.459 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 32' ' ' GLN . . . . . . . . . . . . . 93.7 mm-40 -73.52 -34.44 65.24 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.317 -179.659 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 33' ' ' TYR . . . . . 0.521 ' CZ ' ' OD1' ' X' ' 37' ' ' ASN . 69.0 t80 -61.74 -43.48 98.78 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.88 -179.535 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 34' ' ' ALA . . . . . 0.553 ' HB1' ' O ' ' X' ' 39' ' ' VAL . . . -59.11 -37.63 77.65 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.421 -179.082 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 35' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -64.18 -47.22 80.65 Favored 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 179.221 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 36' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -66.87 -26.08 66.72 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.645 179.602 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 37' ' ' ASN . . . . . 0.521 ' OD1' ' CZ ' ' X' ' 33' ' ' TYR . 1.1 m120 -84.0 -26.66 28.99 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.807 -179.283 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 38' ' ' GLY . . . . . . . . . . . . . . . 112.15 -39.25 2.93 Favored Glycine 0 CA--C 1.531 1.076 0 C-N-CA 121.555 -0.355 . . . . 0.0 112.364 178.622 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 39' ' ' VAL . . . . . 0.553 ' O ' ' HB1' ' X' ' 34' ' ' ALA . 1.6 p -80.78 108.75 14.46 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 CA-C-N 117.4 0.6 . . . . 0.0 111.211 -178.774 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 40' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -127.71 112.31 14.67 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.737 179.306 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 41' ' ' GLY . . . . . 0.469 ' H ' ' CG2' ' X' ' 54' ' ' VAL . . . -142.92 -153.73 5.96 Favored Glycine 0 CA--C 1.533 1.197 0 C-N-CA 120.337 -0.935 . . . . 0.0 112.283 -179.431 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 42' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -74.53 139.13 43.58 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 -179.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 43' ' ' TRP . . . . . . . . . . . . . 90.8 m95 -102.83 162.36 12.99 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.817 0.817 . . . . 0.0 112.686 -178.052 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 44' ' ' THR . . . . . 0.5 ' CG2' ' OG1' ' X' ' 53' ' ' THR . 2.8 t -156.9 167.85 29.23 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.35 -1.295 . . . . 0.0 108.821 179.206 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 45' ' ' TYR . . . . . 0.629 ' CD1' ' CE1' ' X' ' 52' ' ' PHE . 19.1 t80 -172.88 134.45 0.59 Allowed 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 119.748 -0.781 . . . . 0.0 111.771 179.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 46' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -123.66 112.33 17.27 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 115.25 -0.886 . . . . 0.0 108.708 177.87 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 47' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -68.61 -16.33 63.81 Favored 'General case' 0 C--O 1.231 0.121 0 CA-C-O 120.815 0.341 . . . . 0.0 110.988 -179.552 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.16 -13.56 59.64 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.101 -179.824 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 49' ' ' THR . . . . . . . . . . . . . 2.5 p -128.22 3.0 5.77 Favored 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 110.508 -0.182 . . . . 0.0 110.508 -179.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 50' ' ' LYS . . . . . 0.53 ' NZ ' ' SD ' ' X' ' 1' ' ' MET . 64.5 mmtt 41.54 57.48 2.99 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 120.908 -0.317 . . . . 0.0 110.544 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 51' ' ' THR . . . . . . . . . . . . . 96.9 m -147.01 128.67 15.17 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 111.891 0.33 . . . . 0.0 111.891 -179.346 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 52' ' ' PHE . . . . . 0.629 ' CE1' ' CD1' ' X' ' 45' ' ' TYR . 27.9 m-85 -107.84 156.23 19.39 Favored 'General case' 0 C--N 1.345 0.376 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 178.717 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 53' ' ' THR . . . . . 0.5 ' OG1' ' CG2' ' X' ' 44' ' ' THR . 11.6 p -152.14 128.83 10.82 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 178.767 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 54' ' ' VAL . . . . . 0.469 ' CG2' ' H ' ' X' ' 41' ' ' GLY . 10.4 p -112.74 123.98 68.95 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 178.776 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 55' ' ' THR . . . . . 0.471 ' O ' HG23 ' X' ' 55' ' ' THR . 3.0 t -124.93 123.27 39.54 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 116.561 -0.291 . . . . 0.0 111.708 -178.053 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 56' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 . . . . . 0 C--O 1.22 -0.494 0 CA-C-O 118.015 -0.993 . . . . 0.0 110.062 179.36 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' X' X ' 1' ' ' MET . . . . . 0.588 ' SD ' ' CZ ' ' X' ' 3' ' ' TYR . 0.1 OUTLIER . . . . . 0 N--CA 1.493 1.683 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 2' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -126.28 146.23 50.1 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.908 0.385 . . . . 0.0 110.622 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 3' ' ' TYR . . . . . 0.588 ' CZ ' ' SD ' ' X' ' 1' ' ' MET . 73.5 m-85 -115.3 142.66 46.38 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.463 179.462 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 4' ' ' LYS . . . . . . . . . . . . . 10.1 ttmm -119.45 127.2 52.86 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 121.024 0.44 . . . . 0.0 110.187 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 5' ' ' LEU . . . . . 0.708 HD13 ' C ' ' X' ' 5' ' ' LEU . 1.0 OUTLIER -107.8 127.64 53.89 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 179.664 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' X' X ' 6' ' ' ILE . . . . . 0.537 ' N ' HD22 ' X' ' 5' ' ' LEU . 29.2 mm -98.4 132.24 43.9 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.467 0 CA-C-O 120.907 0.384 . . . . 0.0 110.073 -179.474 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 7' ' ' LEU . . . . . 0.418 HD23 HD22 ' X' ' 12' ' ' LEU . 6.2 mp -91.91 113.62 25.94 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.283 -179.156 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 8' ' ' ASN . . . . . . . . . . . . . 20.2 t30 -131.78 87.73 2.48 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 178.165 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 9' ' ' GLY . . . . . 0.62 ' H ' ' NZ ' ' X' ' 13' ' ' LYS . . . -124.62 -163.24 11.62 Favored Glycine 0 N--CA 1.463 0.48 0 N-CA-C 111.542 -0.623 . . . . 0.0 111.542 -178.68 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 10' ' ' LYS . . . . . . . . . . . . . 55.5 mttt -75.94 -48.86 19.56 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 120.86 -0.336 . . . . 0.0 110.982 -179.692 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 11' ' ' THR . . . . . . . . . . . . . 41.3 p -130.73 19.3 5.12 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 112.177 0.436 . . . . 0.0 112.177 -179.301 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 12' ' ' LEU . . . . . 0.765 ' H ' ' HZ1' ' X' ' 13' ' ' LYS . 0.5 OUTLIER -138.4 108.12 6.26 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 120.848 0.356 . . . . 0.0 111.337 -179.435 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' X' X ' 13' ' ' LYS . . . . . 0.765 ' HZ1' ' H ' ' X' ' 12' ' ' LEU . 0.2 OUTLIER -131.78 139.94 49.06 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.264 179.429 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' X' X ' 14' ' ' GLY . . . . . 0.412 ' H ' ' HB2' ' X' ' 7' ' ' LEU . . . 174.6 -155.19 20.59 Favored Glycine 0 CA--C 1.535 1.323 0 N-CA-C 110.839 -0.905 . . . . 0.0 110.839 -179.794 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 15' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -134.4 149.94 50.84 Favored 'General case' 0 N--CA 1.468 0.449 0 O-C-N 122.717 -0.284 . . . . 0.0 110.517 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 2.7 m -148.28 129.5 14.64 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 120.88 -0.328 . . . . 0.0 110.343 178.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 17' ' ' THR . . . . . 0.561 HG23 ' O ' ' X' ' 3' ' ' TYR . 2.6 m -131.66 157.24 44.23 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 120.92 0.39 . . . . 0.0 110.451 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 18' ' ' THR . . . . . . . . . . . . . 7.1 t -152.67 152.81 32.17 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.087 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 19' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -104.2 105.86 16.16 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.785 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 20' ' ' ALA . . . . . . . . . . . . . . . -130.01 162.64 28.24 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.998 -179.336 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 21' ' ' VAL . . . . . 0.442 HG12 ' H ' ' X' ' 21' ' ' VAL . 1.2 p -82.98 -37.58 13.95 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.268 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.716 179.515 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 22' ' ' ASP . . . . . 0.509 ' OD1' ' N ' ' X' ' 23' ' ' ALA . 33.0 t0 -115.47 156.25 25.99 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.943 -179.532 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 23' ' ' ALA . . . . . 0.509 ' N ' ' OD1' ' X' ' 22' ' ' ASP . . . -74.94 -42.78 57.01 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.026 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 24' ' ' ALA . . . . . . . . . . . . . . . -65.71 -39.26 91.01 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.669 -179.054 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 25' ' ' THR . . . . . . . . . . . . . 1.2 t -63.21 -34.57 77.93 Favored 'General case' 0 C--N 1.346 0.437 0 C-N-CA 120.669 -0.413 . . . . 0.0 110.7 -179.561 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.0 -35.82 78.96 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.904 0.383 . . . . 0.0 110.73 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 27' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -58.27 -29.08 65.53 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.665 -179.779 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 28' ' ' LYS . . . . . 0.416 ' O ' ' OE1' ' X' ' 32' ' ' GLN . 41.4 mtmt -57.22 -43.49 82.86 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 120.456 -0.498 . . . . 0.0 110.031 -179.079 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 29' ' ' VAL . . . . . 0.43 ' O ' ' CB ' ' X' ' 33' ' ' TYR . 12.1 t -69.95 -50.76 45.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.459 179.394 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 30' ' ' PHE . . . . . . . . . . . . . 57.9 m-85 -61.54 -43.15 99.39 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.878 -179.319 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 31' ' ' LYS . . . . . . . . . . . . . 68.1 mttt -70.52 -41.78 72.14 Favored 'General case' 0 C--O 1.232 0.155 0 C-N-CA 120.23 -0.588 . . . . 0.0 110.55 -179.499 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 32' ' ' GLN . . . . . 0.416 ' OE1' ' O ' ' X' ' 28' ' ' LYS . 79.2 mt-30 -73.14 -33.52 65.55 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.02 0.438 . . . . 0.0 109.853 179.218 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 33' ' ' TYR . . . . . 0.43 ' CB ' ' O ' ' X' ' 29' ' ' VAL . 27.2 t80 -64.98 -37.62 88.24 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.518 179.844 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 34' ' ' ALA . . . . . 0.52 ' HB1' ' O ' ' X' ' 39' ' ' VAL . . . -59.68 -40.18 86.98 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.611 -179.456 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 35' ' ' ASN . . . . . . . . . . . . . 9.6 m-80 -68.24 -38.44 81.85 Favored 'General case' 0 N--CA 1.456 -0.151 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 179.326 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 36' ' ' ASP . . . . . 0.477 ' OD1' ' N ' ' X' ' 36' ' ' ASP . 0.9 OUTLIER -67.51 -32.15 72.76 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 115.492 -0.776 . . . . 0.0 112.055 -179.866 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' X' X ' 37' ' ' ASN . . . . . 0.623 HD21 ' CG1' ' X' ' 39' ' ' VAL . 17.8 p-10 -91.78 -24.73 19.32 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 -178.431 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 38' ' ' GLY . . . . . 0.543 ' N ' ' OD1' ' X' ' 37' ' ' ASN . . . 118.55 -37.98 3.04 Favored Glycine 0 CA--C 1.534 1.278 0 C-N-CA 121.236 -0.507 . . . . 0.0 113.886 177.726 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 39' ' ' VAL . . . . . 0.623 ' CG1' HD21 ' X' ' 37' ' ' ASN . 1.5 p -80.16 108.39 13.56 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 CA-C-N 118.009 0.905 . . . . 0.0 111.442 -178.064 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 40' ' ' ASP . . . . . . . . . . . . . 22.0 t0 -127.79 111.76 14.01 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.907 179.267 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 41' ' ' GLY . . . . . 0.514 ' H ' ' CG2' ' X' ' 54' ' ' VAL . . . -141.23 -155.37 6.46 Favored Glycine 0 CA--C 1.534 1.27 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.038 -179.589 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 42' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -75.0 136.76 41.25 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-O 120.702 0.287 . . . . 0.0 110.266 -179.682 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 43' ' ' TRP . . . . . . . . . . . . . 82.4 m95 -103.23 162.01 13.33 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.898 0.856 . . . . 0.0 112.535 -178.3 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 44' ' ' THR . . . . . 0.475 ' CG2' ' OG1' ' X' ' 53' ' ' THR . 9.0 t -157.06 166.99 31.76 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 114.071 -1.422 . . . . 0.0 108.384 179.103 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 45' ' ' TYR . . . . . 0.629 ' CE1' ' CE1' ' X' ' 52' ' ' PHE . 16.8 t80 -172.46 133.78 0.65 Allowed 'General case' 0 C--N 1.332 -0.195 0 C-N-CA 119.607 -0.837 . . . . 0.0 112.079 179.943 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 46' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -123.9 112.47 17.29 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 115.125 -0.943 . . . . 0.0 108.482 177.673 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 47' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -67.69 -16.29 64.07 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-O 120.672 0.272 . . . . 0.0 111.068 -179.388 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.35 -14.81 58.73 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.141 -179.77 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 49' ' ' THR . . . . . . . . . . . . . 2.8 p -125.73 2.8 7.48 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 110.44 -0.208 . . . . 0.0 110.44 -179.866 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 50' ' ' LYS . . . . . . . . . . . . . 67.0 mmtt 41.61 58.46 2.74 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 120.884 -0.326 . . . . 0.0 110.551 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 51' ' ' THR . . . . . . . . . . . . . 97.4 m -147.71 126.69 12.8 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 112.132 0.419 . . . . 0.0 112.132 -179.34 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 52' ' ' PHE . . . . . 0.629 ' CE1' ' CE1' ' X' ' 45' ' ' TYR . 26.8 m-85 -107.92 155.55 20.18 Favored 'General case' 0 C--N 1.344 0.352 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 178.436 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 53' ' ' THR . . . . . 0.475 ' OG1' ' CG2' ' X' ' 44' ' ' THR . 47.0 p -151.98 129.49 11.43 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 120.401 -0.52 . . . . 0.0 110.492 179.202 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 54' ' ' VAL . . . . . 0.514 ' CG2' ' H ' ' X' ' 41' ' ' GLY . 10.7 p -113.69 123.62 69.53 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.497 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 178.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 55' ' ' THR . . . . . 0.542 ' O ' HG23 ' X' ' 55' ' ' THR . 4.9 t -125.46 119.89 29.46 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.299 -178.716 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 56' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 . . . . . 0 C--O 1.219 -0.507 0 CA-C-O 118.009 -0.996 . . . . 0.0 110.088 179.635 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' X' X ' 1' ' ' MET . . . . . 0.526 ' SD ' ' NZ ' ' X' ' 50' ' ' LYS . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.665 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 2' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -127.19 145.18 50.85 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 120.908 0.385 . . . . 0.0 110.972 -179.623 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 3' ' ' TYR . . . . . 0.524 ' O ' HG23 ' X' ' 17' ' ' THR . 61.3 m-85 -122.36 137.68 54.77 Favored 'General case' 0 CA--C 1.518 -0.259 0 CA-C-N 115.835 -0.621 . . . . 0.0 109.495 179.213 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 4' ' ' LYS . . . . . . . . . . . . . 45.3 tttp -119.58 127.62 53.14 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 120.978 0.418 . . . . 0.0 110.721 -179.639 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 5' ' ' LEU . . . . . 0.695 HD13 ' C ' ' X' ' 5' ' ' LEU . 1.0 OUTLIER -108.76 127.77 54.3 Favored 'General case' 0 N--CA 1.464 0.271 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 179.077 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' X' X ' 6' ' ' ILE . . . . . 0.531 ' N ' HD22 ' X' ' 5' ' ' LEU . 29.1 mm -98.12 132.57 42.81 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.46 0 CA-C-O 121.137 0.494 . . . . 0.0 110.006 -179.207 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 7' ' ' LEU . . . . . 0.475 HD23 HD22 ' X' ' 12' ' ' LEU . 6.0 mp -91.65 115.26 27.9 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.443 -178.922 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 8' ' ' ASN . . . . . . . . . . . . . 21.4 t30 -134.28 86.95 2.31 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 108.045 -1.095 . . . . 0.0 108.045 177.578 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 9' ' ' GLY . . . . . 0.516 ' H ' ' HD3' ' X' ' 13' ' ' LYS . . . -125.97 -163.36 11.53 Favored Glycine 0 C--N 1.335 0.479 0 N-CA-C 111.506 -0.638 . . . . 0.0 111.506 -178.871 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 10' ' ' LYS . . . . . . . . . . . . . 57.8 mttt -76.97 -46.98 22.15 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.973 -0.291 . . . . 0.0 111.155 -179.655 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 11' ' ' THR . . . . . . . . . . . . . 42.1 p -130.57 18.33 5.26 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 -179.26 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 12' ' ' LEU . . . . . 0.657 ' N ' ' HZ2' ' X' ' 13' ' ' LYS . 0.3 OUTLIER -138.59 100.4 4.07 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 120.87 -0.332 . . . . 0.0 111.52 -179.632 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' X' X ' 13' ' ' LYS . . . . . 0.657 ' HZ2' ' N ' ' X' ' 12' ' ' LEU . 0.0 OUTLIER -122.21 137.56 54.79 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 178.895 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' X' X ' 14' ' ' GLY . . . . . 0.435 ' O ' ' OE1' ' X' ' 15' ' ' GLU . . . 173.44 -155.16 21.8 Favored Glycine 0 CA--C 1.534 1.271 0 N-CA-C 110.923 -0.871 . . . . 0.0 110.923 -179.902 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 15' ' ' GLU . . . . . 0.435 ' OE1' ' O ' ' X' ' 14' ' ' GLY . 5.1 mm-40 -134.73 150.64 50.6 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 110.061 -0.348 . . . . 0.0 110.061 179.615 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 1.9 m -148.08 129.67 14.99 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.301 178.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 17' ' ' THR . . . . . 0.524 HG23 ' O ' ' X' ' 3' ' ' TYR . 2.3 m -129.41 157.21 42.6 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 120.98 0.419 . . . . 0.0 110.608 179.858 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 18' ' ' THR . . . . . . . . . . . . . 7.4 t -149.26 153.31 37.38 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.85 -179.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 19' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -103.81 105.67 15.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.218 -0.446 . . . . 0.0 109.847 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 20' ' ' ALA . . . . . . . . . . . . . . . -136.28 161.97 34.3 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.635 -179.695 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 21' ' ' VAL . . . . . 0.422 ' H ' HG12 ' X' ' 21' ' ' VAL . 1.1 p -87.3 -40.79 14.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.44 179.345 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 22' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -104.75 155.78 18.58 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.402 -179.163 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 23' ' ' ALA . . . . . . . . . . . . . . . -75.09 -45.94 37.93 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.943 179.772 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 24' ' ' ALA . . . . . . . . . . . . . . . -62.88 -40.22 96.85 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.518 -179.059 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 25' ' ' THR . . . . . . . . . . . . . 1.2 t -63.28 -33.06 74.68 Favored 'General case' 0 C--N 1.346 0.432 0 O-C-N 122.016 -0.428 . . . . 0.0 110.716 -179.706 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.1 -35.84 78.8 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.88 0.371 . . . . 0.0 110.581 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 27' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -62.46 -28.57 69.91 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.509 -179.733 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 28' ' ' LYS . . . . . 0.418 ' O ' ' OE1' ' X' ' 32' ' ' GLN . 84.0 mttt -57.51 -43.88 84.6 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.255 -0.429 . . . . 0.0 109.885 -179.012 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 29' ' ' VAL . . . . . 0.441 ' O ' ' CB ' ' X' ' 33' ' ' TYR . 13.1 t -70.03 -50.27 49.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.498 179.366 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 30' ' ' PHE . . . . . . . . . . . . . 55.9 m-85 -61.67 -43.53 98.67 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.831 -179.363 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 31' ' ' LYS . . . . . . . . . . . . . 72.0 mttt -69.5 -42.14 75.13 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 120.352 -0.539 . . . . 0.0 110.49 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 32' ' ' GLN . . . . . 0.418 ' OE1' ' O ' ' X' ' 28' ' ' LYS . 79.6 mt-30 -73.21 -33.24 65.26 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.044 0.45 . . . . 0.0 109.954 179.371 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 33' ' ' TYR . . . . . 0.524 ' CZ ' ' OD1' ' X' ' 37' ' ' ASN . 65.9 t80 -68.31 -36.97 80.13 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.704 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.23 -38.51 80.15 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.43 -179.23 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 35' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -60.85 -48.09 83.4 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 109.835 -0.432 . . . . 0.0 109.835 179.39 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 36' ' ' ASP . . . . . 0.407 ' OD1' ' N ' ' X' ' 36' ' ' ASP . 1.6 m-20 -66.87 -24.44 66.12 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.977 179.554 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 37' ' ' ASN . . . . . 0.524 ' OD1' ' CZ ' ' X' ' 33' ' ' TYR . 1.0 OUTLIER -86.62 -26.81 24.21 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.082 -178.702 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' X' X ' 38' ' ' GLY . . . . . . . . . . . . . . . 106.48 -34.98 5.34 Favored Glycine 0 CA--C 1.532 1.146 0 C-N-CA 121.343 -0.456 . . . . 0.0 112.915 178.499 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 39' ' ' VAL . . . . . 0.426 HG12 ' H ' ' X' ' 39' ' ' VAL . 2.1 p -80.4 107.88 13.23 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 CA-C-N 117.728 0.764 . . . . 0.0 110.873 -178.831 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 40' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -127.8 110.83 12.99 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 115.789 -0.642 . . . . 0.0 109.964 179.551 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 41' ' ' GLY . . . . . 0.513 ' H ' ' CG2' ' X' ' 54' ' ' VAL . . . -141.28 -155.39 6.46 Favored Glycine 0 CA--C 1.532 1.115 0 C-N-CA 120.763 -0.732 . . . . 0.0 111.769 -179.541 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 42' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -75.08 131.14 40.34 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 120.94 0.4 . . . . 0.0 110.202 -179.792 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 43' ' ' TRP . . . . . . . . . . . . . 83.6 m95 -97.38 161.42 13.8 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.651 0.739 . . . . 0.0 112.101 -178.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 44' ' ' THR . . . . . 0.5 ' CG2' ' OG1' ' X' ' 53' ' ' THR . 2.5 t -157.05 167.95 28.91 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.559 -1.2 . . . . 0.0 108.786 179.33 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 45' ' ' TYR . . . . . 0.635 ' CD1' ' CE1' ' X' ' 52' ' ' PHE . 22.1 t80 -170.56 134.23 1.08 Allowed 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 119.7 -0.8 . . . . 0.0 111.856 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 46' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -123.73 112.38 17.28 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 115.145 -0.934 . . . . 0.0 108.646 177.748 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 47' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -68.45 -16.39 63.88 Favored 'General case' 0 C--O 1.231 0.096 0 CA-C-O 120.716 0.294 . . . . 0.0 110.998 -179.419 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.35 -13.55 59.55 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.068 -179.748 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 49' ' ' THR . . . . . . . . . . . . . 2.6 p -128.19 2.95 5.79 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 110.647 -0.131 . . . . 0.0 110.647 -179.768 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 50' ' ' LYS . . . . . 0.526 ' NZ ' ' SD ' ' X' ' 1' ' ' MET . 64.2 mmtt 41.87 57.47 3.14 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 120.754 -0.378 . . . . 0.0 110.442 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 51' ' ' THR . . . . . . . . . . . . . 94.5 m -147.26 128.3 14.58 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 112.06 0.392 . . . . 0.0 112.06 -179.309 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 52' ' ' PHE . . . . . 0.635 ' CE1' ' CD1' ' X' ' 45' ' ' TYR . 29.2 m-85 -107.81 154.82 20.99 Favored 'General case' 0 C--N 1.343 0.325 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 178.561 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 53' ' ' THR . . . . . 0.5 ' OG1' ' CG2' ' X' ' 44' ' ' THR . 34.2 p -151.42 129.1 11.53 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 120.531 -0.467 . . . . 0.0 110.312 179.126 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 54' ' ' VAL . . . . . 0.513 ' CG2' ' H ' ' X' ' 41' ' ' GLY . 12.5 p -113.57 123.81 69.59 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.448 0 N-CA-C 109.381 -0.599 . . . . 0.0 109.381 179.01 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 55' ' ' THR . . . . . 0.554 ' O ' HG23 ' X' ' 55' ' ' THR . 5.3 t -125.45 120.3 30.62 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.399 -178.469 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 56' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 . . . . . 0 C--O 1.22 -0.481 0 CA-C-O 117.971 -1.014 . . . . 0.0 110.137 179.298 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' X' X ' 1' ' ' MET . . . . . 0.582 ' SD ' ' CE2' ' X' ' 3' ' ' TYR . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.705 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 2' ' ' GLN . . . . . . . . . . . . . 24.8 mt-30 -117.88 149.36 41.0 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 121.278 0.561 . . . . 0.0 111.659 -178.563 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 3' ' ' TYR . . . . . 0.582 ' CE2' ' SD ' ' X' ' 1' ' ' MET . 63.2 m-85 -123.39 143.98 49.77 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-N 115.287 -0.87 . . . . 0.0 108.769 178.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 4' ' ' LYS . . . . . . . . . . . . . 5.1 tttm -119.43 128.65 54.22 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 121.053 0.454 . . . . 0.0 111.118 -179.117 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 5' ' ' LEU . . . . . 0.709 HD13 ' C ' ' X' ' 5' ' ' LEU . 1.0 OUTLIER -108.93 128.27 54.78 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.283 179.697 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' X' X ' 6' ' ' ILE . . . . . 0.542 ' N ' HD22 ' X' ' 5' ' ' LEU . 26.5 mm -98.88 132.73 43.62 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.439 0 CA-C-O 121.043 0.449 . . . . 0.0 110.144 -179.272 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 7' ' ' LEU . . . . . 0.481 HD21 HD22 ' X' ' 37' ' ' ASN . 6.3 mp -92.09 108.78 20.19 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.36 -179.088 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 8' ' ' ASN . . . . . . . . . . . . . 11.9 t30 -131.2 87.72 2.51 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 178.621 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 9' ' ' GLY . . . . . 0.812 ' C ' ' HZ1' ' X' ' 13' ' ' LYS . . . -123.04 -147.4 7.36 Favored Glycine 0 N--CA 1.464 0.533 0 N-CA-C 111.505 -0.638 . . . . 0.0 111.505 -179.139 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 10' ' ' LYS . . . . . . . . . . . . . 48.5 mttt -77.78 -51.76 10.0 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 121.054 -0.258 . . . . 0.0 111.435 -179.453 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 11' ' ' THR . . . . . 0.444 ' C ' ' HZ3' ' X' ' 13' ' ' LYS . 41.5 p -130.53 -19.4 3.05 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 112.193 0.442 . . . . 0.0 112.193 -179.408 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 12' ' ' LEU . . . . . 0.779 ' N ' ' HZ3' ' X' ' 13' ' ' LYS . 0.6 OUTLIER -91.37 118.63 30.69 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 120.753 0.311 . . . . 0.0 111.165 -178.803 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' X' X ' 13' ' ' LYS . . . . . 0.812 ' HZ1' ' C ' ' X' ' 9' ' ' GLY . 0.1 OUTLIER -139.26 139.97 37.55 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 120.989 0.423 . . . . 0.0 110.434 179.65 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' X' X ' 14' ' ' GLY . . . . . 0.418 ' H ' ' HB2' ' X' ' 7' ' ' LEU . . . 174.45 -154.72 19.65 Favored Glycine 0 CA--C 1.534 1.27 0 N-CA-C 110.871 -0.891 . . . . 0.0 110.871 -179.777 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 15' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -134.24 151.01 51.07 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 120.677 0.275 . . . . 0.0 110.297 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 16' ' ' THR . . . . . . . . . . . . . 2.7 m -147.68 129.43 15.17 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.027 178.838 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 17' ' ' THR . . . . . 0.523 HG23 ' O ' ' X' ' 3' ' ' TYR . 2.0 m -130.77 158.57 39.78 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 120.903 0.382 . . . . 0.0 110.818 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 18' ' ' THR . . . . . . . . . . . . . 6.3 t -154.25 153.29 31.48 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.463 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 19' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -103.85 113.12 26.41 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 179.653 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 20' ' ' ALA . . . . . . . . . . . . . . . -137.34 161.09 37.22 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.018 -179.544 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 21' ' ' VAL . . . . . 0.454 ' H ' HG12 ' X' ' 21' ' ' VAL . 1.1 p -80.83 -39.82 18.3 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.335 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.58 179.331 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 22' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -116.94 156.79 26.81 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.999 -179.432 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.77 -41.31 60.29 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.962 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.18 -36.37 83.86 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.617 -179.126 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 25' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -70.23 -31.77 69.34 Favored 'General case' 0 C--N 1.345 0.384 0 O-C-N 122.091 -0.381 . . . . 0.0 110.795 -179.609 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.03 -35.52 78.4 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.974 0.416 . . . . 0.0 110.703 -179.825 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 27' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -57.61 -29.04 64.19 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.866 -179.565 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 28' ' ' LYS . . . . . . . . . . . . . 41.0 mtmt -56.0 -42.41 76.34 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 120.391 -0.524 . . . . 0.0 110.497 -178.685 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 29' ' ' VAL . . . . . . . . . . . . . 12.1 t -70.12 -51.16 41.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-O 120.889 0.376 . . . . 0.0 110.505 179.283 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 30' ' ' PHE . . . . . . . . . . . . . 60.2 m-85 -61.97 -42.43 99.12 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.971 -179.29 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 31' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -63.06 -51.31 67.17 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 120.738 -0.385 . . . . 0.0 111.075 -179.305 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 32' ' ' GLN . . . . . 0.408 ' O ' ' OD1' ' X' ' 36' ' ' ASP . 79.6 mt-30 -72.09 -32.86 67.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.139 -179.489 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 33' ' ' TYR . . . . . . . . . . . . . 29.1 t80 -60.9 -34.79 75.21 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.873 -179.406 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 34' ' ' ALA . . . . . 0.606 ' HB1' ' O ' ' X' ' 39' ' ' VAL . . . -59.9 -43.55 94.76 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.33 -179.414 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 35' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -66.84 -36.22 81.83 Favored 'General case' 0 N--CA 1.447 -0.621 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 179.4 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 36' ' ' ASP . . . . . 0.494 ' OD1' ' N ' ' X' ' 36' ' ' ASP . 0.7 OUTLIER -67.38 -31.05 71.02 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.893 -179.857 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' X' X ' 37' ' ' ASN . . . . . 0.608 HD21 ' CG1' ' X' ' 39' ' ' VAL . 15.8 p-10 -95.57 -24.58 16.54 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 111.951 0.352 . . . . 0.0 111.951 -178.528 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 38' ' ' GLY . . . . . 0.533 ' N ' ' OD1' ' X' ' 37' ' ' ASN . . . 121.24 -41.06 1.97 Allowed Glycine 0 CA--C 1.532 1.155 0 C-N-CA 121.308 -0.472 . . . . 0.0 113.514 177.957 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 39' ' ' VAL . . . . . 0.608 ' CG1' HD21 ' X' ' 37' ' ' ASN . 1.5 p -80.19 108.57 13.77 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.325 0 CA-C-N 117.735 0.767 . . . . 0.0 111.597 -178.149 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 40' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -127.74 111.54 13.79 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.881 179.084 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 41' ' ' GLY . . . . . 0.513 ' H ' ' CG2' ' X' ' 54' ' ' VAL . . . -141.48 -156.07 6.69 Favored Glycine 0 CA--C 1.534 1.232 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.077 -179.501 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 42' ' ' GLU . . . . . 0.604 ' CD ' ' H ' ' X' ' 42' ' ' GLU . 2.5 mp0 -75.14 139.12 42.5 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-O 120.743 0.306 . . . . 0.0 110.251 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 43' ' ' TRP . . . . . . . . . . . . . 81.3 m95 -103.86 163.47 12.33 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.866 0.841 . . . . 0.0 112.679 -178.262 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 44' ' ' THR . . . . . 0.48 ' CG2' ' OG1' ' X' ' 53' ' ' THR . 10.4 t -156.98 167.07 31.57 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 114.125 -1.398 . . . . 0.0 108.341 178.955 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 45' ' ' TYR . . . . . 0.623 ' CD1' ' CZ ' ' X' ' 52' ' ' PHE . 27.5 t80 -171.72 135.44 0.87 Allowed 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 119.603 -0.839 . . . . 0.0 111.858 -179.935 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 46' ' ' ASP . . . . . . . . . . . . . 11.7 t0 -123.29 112.44 17.63 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 177.785 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 47' ' ' ASP . . . . . . . . . . . . . 49.2 t0 -64.6 -15.67 61.5 Favored 'General case' 0 C--N 1.334 -0.076 0 CA-C-N 116.661 -0.245 . . . . 0.0 111.518 -179.143 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.99 -36.15 36.42 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 120.872 -0.331 . . . . 0.0 111.538 -179.494 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 49' ' ' THR . . . . . . . . . . . . . 2.8 p -102.84 2.91 36.04 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 110.632 -0.136 . . . . 0.0 110.632 -179.534 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 50' ' ' LYS . . . . . . . . . . . . . 14.0 mmmt 41.89 56.53 3.43 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 120.68 0.276 . . . . 0.0 110.412 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 51' ' ' THR . . . . . . . . . . . . . 39.0 m -144.32 129.49 18.67 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 -179.241 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 52' ' ' PHE . . . . . 0.623 ' CZ ' ' CD1' ' X' ' 45' ' ' TYR . 53.1 m-85 -108.31 153.77 22.76 Favored 'General case' 0 C--N 1.344 0.342 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 178.524 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 53' ' ' THR . . . . . 0.48 ' OG1' ' CG2' ' X' ' 44' ' ' THR . 65.9 p -151.23 130.12 12.47 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 120.522 -0.471 . . . . 0.0 110.476 179.185 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 54' ' ' VAL . . . . . 0.513 ' CG2' ' H ' ' X' ' 41' ' ' GLY . 11.2 p -113.53 123.98 69.72 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 179.21 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 55' ' ' THR . . . . . 0.516 ' O ' HG23 ' X' ' 55' ' ' THR . 4.2 t -125.34 120.68 31.81 Favored 'General case' 0 N--CA 1.474 0.725 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.351 -178.719 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 56' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 . . . . . 0 C--O 1.22 -0.463 0 CA-C-O 117.983 -1.008 . . . . 0.0 110.027 179.607 . . . . . . . . 0 0 . 1 stop_ save_